#
#    Open Babel file: fragments.txt
#
#  Copyright (c) 2007-2008 by Geoffrey R Hutchison
#  Part of the Open Babel package, under the GNU General Public License (GPL)
#
# Fragments for OBBuilder coordinate generation 
# These consist of a generic SMARTS pattern
# followed by the 3D coordinates of all heavy atoms
# 
# Fragments are ordered by length of SMARTS pattern
#  (i.e., most complicated will match first)
#
# This file contains ~1000 of the most common ring fragments
# from analysis over the NCI database and ZINC
#
# NCI: http://cactus.nci.nih.gov/ncidb2/download.html
# ZINC: http://zinc.docking.org/
#
A1AA[A@H]2[A@@H](A1)AA[A@@H]1[A@@H]2AA[A@@H]2AAA[A@@H]12
   3.605   0.291   1.198
   3.027   1.587   0.669
   2.644   1.364  -0.794
   1.699   0.173  -0.941
   2.335  -1.105  -0.401
   2.741  -0.946   1.065
   1.404  -2.296  -0.571
  -0.016  -2.067  -0.087
  -0.596  -0.718  -0.481
   0.387   0.426  -0.207
  -0.193   1.781  -0.591
  -1.557   2.040   0.063
  -2.491   0.896  -0.268
  -3.833   0.920   0.421
  -4.263  -0.539   0.513
  -3.026  -1.397   0.128
  -1.866  -0.410   0.284
A1AA[A@H]2[A@@H](A1)AA[A@@H]1[A@@H]2AA[A@@H]2AAA[A@H]12
  -3.236   0.393  -1.528
  -2.521   1.648  -1.024
  -2.453   1.618   0.504
  -1.682   0.376   0.955
  -2.396  -0.880   0.451
  -2.464  -0.849  -1.077
  -1.636  -2.121   0.874
  -0.217  -2.076   0.303
   0.502  -0.828   0.819
  -0.263   0.421   0.383
   0.458   1.663   0.918
   1.847   1.727   0.289
   2.682   0.509   0.692
   3.905   0.471  -0.264
   3.487  -0.394  -1.467
   2.049  -0.884  -1.181
   1.938  -0.795   0.352
A1AA[A@H]2[A@@H](A1)AA[A@@H]1[A@H]2AA[A@@H]2AAA[A@@H]12
   3.207   0.123   1.596
   2.522   1.465   1.356
   1.226   1.270   0.571
   1.480   0.577  -0.761
   2.216  -0.743  -0.560
   3.477  -0.585   0.275
   1.285  -1.782   0.066
   0.177  -2.071  -0.950
  -0.662  -0.808  -1.145
   0.187   0.390  -1.545
  -0.616   1.684  -1.599
  -1.531   1.917  -0.396
  -2.398   0.698  -0.171
  -3.269   0.714   1.090
  -3.385  -0.771   1.515
  -2.455  -1.575   0.564
  -1.460  -0.504   0.095
A1AA[A@H]2[A@H](A1)AA[A@@H]1[A@@H]2AA[A@@H]2AAA[A@@H]12
   4.419  -0.056  -0.088
   3.862  -1.419   0.260
   2.442  -1.518  -0.306
   1.598  -0.349   0.212
   2.176   0.973  -0.295
   3.596   1.163   0.253
   1.307   2.137   0.187
  -0.124   1.961  -0.323
  -0.695   0.650   0.222
   0.167  -0.516  -0.286
  -0.389  -1.862   0.167
  -1.860  -2.030  -0.248
  -2.633  -0.874   0.354
  -4.129  -0.826   0.061
  -4.485   0.679  -0.016
  -3.150   1.455   0.149
  -2.102   0.432  -0.302
A1AA[A@@H]2[A@@H](A1)AA[A@@H]1[A@@H]2AA[A@H]2AAA[A@H]12
   4.207   0.075   0.755
   3.785  -1.335   0.352
   2.260  -1.491   0.359
   1.634  -0.441  -0.551
   2.019   0.946  -0.035
   3.526   1.137  -0.114
   1.233   2.029  -0.758
  -0.240   1.931  -0.329
  -0.495   0.558   0.276
   0.111  -0.538  -0.602
  -0.388  -1.906  -0.160
  -1.899  -2.055  -0.382
  -2.579  -0.709  -0.427
  -4.030  -0.718   0.120
  -4.300   0.794   0.357
  -2.910   1.451   0.564
  -1.933   0.271   0.575
A1AA[A@H]2[A@@H](A1)AA[A@H]1[A@H]2AA[A@@H]2AAA[A@@H]12
  -3.991  -0.069   0.903
  -3.076  -1.287   1.094
  -2.419  -1.583  -0.246
  -1.677  -0.411  -0.837
  -2.273   0.956  -0.658
  -3.103   1.130   0.616
  -1.292   2.104  -0.659
   0.201   1.888  -0.646
   0.403   0.593   0.151
  -0.172  -0.528  -0.720
   0.311  -1.878  -0.213
   1.830  -2.033  -0.366
   2.521  -0.684  -0.425
   3.931  -0.720   0.226
   4.182   0.743   0.662
   2.809   1.467   0.599
   1.814   0.310   0.521
a1aa2[aH]a1A=A1A=AA(=A1)A=a1aaa(=AA3=AA(=A2)A=A3)[aH]1
  -0.838   4.124   0.065
   0.521   4.173   0.065
   1.004   2.851   0.027
  -0.082   2.004   0.015
  -1.226   2.771   0.028
  -2.541   2.334   0.006
  -2.909   0.988  -0.023
  -4.298   0.513  -0.081
  -4.244  -0.837  -0.082
  -2.820  -1.199  -0.024
  -2.102  -0.075  -0.002
  -2.347  -2.512   0.005
  -1.005  -2.851   0.027
  -0.520  -4.173   0.065
   0.838  -4.124   0.065
   1.225  -2.771   0.028
   2.540  -2.334   0.006
   2.909  -0.987  -0.024
   2.102   0.075  -0.005
   2.821   1.199  -0.025
   2.348   2.512   0.005
   4.244   0.837  -0.081
   4.298  -0.513  -0.080
   0.081  -2.004   0.016
A1AA[A@H]2[A@@H](A1)AA[A@@H]1[A@H]2AA[A@@H]2AAA[A@H]12
  -3.453  -0.174   1.243
  -3.160  -1.390   0.399
  -2.786  -0.957  -1.009
  -1.723   0.140  -1.067
  -2.008   1.303  -0.147
  -2.440   0.942   1.269
  -0.853   2.302  -0.065
   0.455   1.569   0.267
   0.749   0.618  -0.881
  -0.326  -0.454  -0.976
  -0.177  -1.493   0.118
   1.204  -2.127   0.098
   2.377  -1.206  -0.069
   3.077  -0.781   1.219
   3.745   0.574   0.918
   3.171   1.088  -0.410
   2.147   0.047  -0.908
A1AA[A@H]2[A@H](A1)AA[A@@H]1[A@@H]2AA[A@@H]2AAA[A@H]12
  -4.343   0.248  -0.530
  -3.710   1.565  -0.077
  -2.224   1.570  -0.444
  -1.524   0.402   0.252
  -2.155  -0.916  -0.205
  -3.640  -0.921   0.164
  -1.455  -2.091   0.477
   0.036  -2.080   0.129
   0.650  -0.763   0.601
  -0.040   0.401  -0.113
   0.597   1.674   0.361
   2.092   1.795   0.189
   2.802   0.592   0.819
   4.199   0.507   0.155
   4.025  -0.391  -1.085
   2.552  -0.864  -1.084
   2.138  -0.729   0.391
A1AA[A@H]2[A@H](A1)AA[A@H]1[A@@H]2AA[A@@H]2AAA[A@@H]12
  -4.143  -0.139   0.595
  -3.577   1.279   0.495
  -2.479   1.310  -0.570
  -1.355   0.348  -0.162
  -1.913  -1.066  -0.076
  -3.027  -1.113   0.976
  -0.812  -2.039   0.340
   0.353  -2.010  -0.629
   0.799  -0.662  -1.095
  -0.214   0.457  -1.150
   0.493   1.811  -0.978
   1.107   1.911   0.423
   1.956   0.698   0.701
   3.431   0.973   1.049
   4.128  -0.380   0.755
   3.139  -1.212  -0.107
   2.114  -0.166  -0.568
A1AA[A@H]2[A@@H](A1)AA[A@@H]1[A@@H]2AA[A@H]2AAA[A@H]12
  -4.045  -0.021   0.909
  -3.340  -1.370   0.860
  -2.508  -1.531  -0.389
  -1.663  -0.344  -0.782
  -2.208   1.000  -0.436
  -2.992   1.085   0.856
  -1.282   2.185  -0.594
   0.103   1.904  -0.003
   0.644   0.665  -0.708
  -0.226  -0.535  -0.335
   0.433  -1.808  -0.843
   1.725  -2.094  -0.056
   2.320  -0.824   0.493
   3.847  -0.810   0.534
   4.165   0.671   0.744
   2.940   1.460   0.207
   2.088   0.370  -0.456
A1AA[A@@H]2[A@@H](A1)AA[A@@H]1[A@H]2AA[A@H]2AAA[A@H]12
  -4.368  -0.279   0.219
  -4.037   1.105   0.708
  -2.548   1.283   1.014
  -1.678   0.497   0.064
  -2.060  -0.958  -0.126
  -3.455  -0.967  -0.778
  -1.027  -1.624  -1.031
   0.297  -1.743  -0.279
   0.603  -0.526   0.565
  -0.191   0.721   0.200
   0.360   1.444  -1.026
   1.832   1.831  -0.810
   2.615   0.558  -0.583
   4.087   0.736  -0.171
   4.431  -0.586   0.563
   3.078  -1.314   0.818
   2.063  -0.177   0.651
A1AA[A@H]2[A@H](A1)AA[A@@H]1[A@H]2AA[A@@H]2AAA[A@@H]12
   4.324   0.189   0.398
   3.852   1.409  -0.361
   2.342   1.556  -0.173
   1.617   0.259  -0.541
   2.086  -0.879   0.349
   3.591  -1.116   0.201
   1.337  -2.162  -0.001
  -0.151  -1.978   0.232
  -0.742  -0.779  -0.492
   0.121   0.462  -0.478
  -0.310   1.418   0.628
  -1.678   2.030   0.272
  -2.574   0.946  -0.281
  -4.010   0.946   0.274
  -4.499  -0.503   0.036
  -3.234  -1.358  -0.238
  -2.071  -0.440   0.174
A1AA[A@@H]2[A@H](A1)AA[A@@H]1[A@@H]2AA[A@H]2AAA[A@H]12
   3.782   0.075  -1.058
   3.252   1.448  -0.786
   2.527   1.486   0.542
   1.669   0.295   0.854
   2.206  -1.067   0.547
   2.977  -1.145  -0.774
   1.240  -2.247   0.520
  -0.228  -1.867   0.706
  -0.420  -0.606  -0.142
   0.186   0.527   0.690
  -0.216   1.872   0.113
  -1.733   2.092   0.255
  -2.474   0.790   0.302
  -3.901   0.799  -0.282
  -4.208  -0.706  -0.484
  -2.843  -1.445  -0.432
  -1.816  -0.302  -0.572
A1AA[A@H]2[A@@H](A1)AA[A@H]1[A@@H]2AA[A@@H]2AAA[A@H]12
   4.117   0.334   0.406
   3.548   1.521  -0.374
   2.022   1.501  -0.282
   1.483   0.205  -0.893
   2.073  -0.998  -0.154
   3.597  -0.966  -0.210
   1.603  -0.949   1.282
   0.116  -0.837   1.534
  -0.443   0.335   0.717
  -0.039   0.184  -0.749
  -0.600  -1.144  -1.264
  -2.124  -1.063  -1.234
  -2.639  -0.845   0.190
  -4.113  -0.374   0.059
  -4.069   1.164  -0.010
  -2.583   1.570   0.132
  -1.951   0.363   0.850
A1=A[A@@H]2A(=AA1)AA[A@@H]1[A@@H]3AAA[A@H]3AA[A@@H]21
  -3.655  -1.352  -0.370
  -2.528  -1.469   0.317
  -1.640  -0.329   0.670
  -2.120   0.992   0.124
  -3.263   1.138  -0.564
  -4.103  -0.031  -0.844
  -1.242   2.158   0.365
   0.220   1.944  -0.018
   0.669   0.652   0.663
   2.120   0.325   0.485
   3.035   1.432  -0.061
   4.298   0.636  -0.494
   3.897  -0.835  -0.521
   2.376  -0.810  -0.524
   1.728  -2.100  -0.091
   0.413  -1.832   0.660
  -0.204  -0.519   0.200
A1AA[A@H]2[A@@H](A1)AA[A@H]1[A@H]2AA[A@@H]2AAA[A@H]12
   3.744   0.225  -1.048
   2.967  -1.014  -1.499
   1.518  -0.899  -1.030
   1.472  -0.811   0.498
   2.274   0.404   0.967
   3.716   0.308   0.479
   1.622   1.647   0.405
   0.143   1.840   0.654
  -0.606   0.566   0.243
   0.009  -0.647   0.935
  -0.759  -1.905   0.504
  -2.203  -1.782   0.984
  -2.871  -0.563   0.394
  -2.997  -0.639  -1.139
  -3.252   0.828  -1.555
  -2.697   1.708  -0.416
  -2.080   0.735   0.625
A1AA[A@H]2[A@H](A1)AA[A@@H]1[A@@H]2AA[A@H]2AAA[A@H]12
   4.375   0.011   0.542
   3.921   1.303  -0.136
   2.429   1.534   0.090
   1.610   0.350  -0.438
   2.083  -0.921   0.283
   3.562  -1.171   0.009
   1.245  -2.138  -0.086
  -0.237  -1.891   0.253
  -0.676  -0.664  -0.528
   0.146   0.545  -0.061
  -0.504   1.816  -0.580
  -1.783   2.070   0.245
  -2.486   0.764   0.527
  -4.020   0.816   0.373
  -4.422  -0.667   0.178
  -3.117  -1.439  -0.159
  -2.129  -0.317  -0.510
A1=A[A@H]2[A@H](AA1)AA[A@H]1[A@@H]3AAA[A@H]3AA[A@H]21
   3.791   1.356   0.182
   2.467   1.526   0.156
   1.598   0.369  -0.259
   2.187  -0.929   0.297
   3.574  -1.046  -0.148
   4.352   0.049  -0.208
   1.353  -2.112  -0.192
  -0.085  -1.952   0.309
  -0.676  -0.645  -0.220
  -2.080  -0.441   0.315
  -3.115  -1.491  -0.104
  -4.462  -0.735   0.057
  -4.133   0.774  -0.056
  -2.640   0.840  -0.362
  -1.882   2.023   0.206
  -0.412   1.872  -0.221
   0.170   0.546   0.256
A1AA[A@H]2[A@H](A1)AA[A@H]1[A@@H]2AA[A@@H]2AAA[A@H]12
  -4.270   0.104  -0.103
  -3.698  -1.299  -0.295
  -2.368  -1.451   0.436
  -1.358  -0.399  -0.045
  -1.956   0.986   0.194
  -3.262   1.154  -0.573
  -0.952   2.060  -0.220
   0.272   1.957   0.690
   0.921   0.579   0.583
  -0.080  -0.540   0.777
   0.555  -1.885   0.530
   1.528  -2.080  -0.599
   2.447  -0.898  -0.783
   3.571  -0.838   0.258
   3.944   0.654   0.374
   2.962   1.429  -0.530
   1.744   0.467  -0.695
A1AA[A@H]2[A@H](A1)AA[A@H]1[A@H]2AA[A@@H]2AAA[A@@H]12
  -4.204   0.109   0.817
  -3.777  -1.313   0.484
  -2.256  -1.469   0.383
  -1.684  -0.468  -0.515
  -1.987   0.952  -0.076
  -3.544   1.082  -0.106
  -1.238   1.974  -0.835
   0.230   1.969  -0.303
   0.494   0.525   0.172
  -0.097  -0.537  -0.703
   0.445  -1.919  -0.517
   1.921  -2.089  -0.132
   2.574  -0.738  -0.346
   4.101  -0.639   0.058
   4.236   0.817   0.495
   2.877   1.444   0.528
   1.908   0.300   0.596
A1AA[A@H]2[A@H](A1)AA[A@@H]1[A@H]2AA[A@@H]2AAA[A@H]12
   4.119  -0.248   0.748
   4.016   0.849  -0.311
   2.585   1.379  -0.384
   1.606   0.245  -0.707
   1.731  -0.841   0.357
   3.156  -1.388   0.408
   0.736  -1.969   0.103
  -0.691  -1.406   0.126
  -0.831  -0.324  -0.939
   0.176   0.797  -0.702
  -0.118   1.426   0.667
  -1.526   1.968   0.625
  -2.662   1.142   0.107
  -3.288   0.284   1.213
  -3.525  -1.113   0.613
  -3.228  -1.001  -0.894
  -2.257   0.200  -1.029
A1AA[A@H]2[A@H](A1)AA[A@H]1[A@H]2AA[A@@H]2AAA[A@H]12
   3.812   0.141   1.168
   3.441   1.470   0.512
   1.926   1.538   0.276
   1.541   0.377  -0.638
   1.854  -0.935   0.087
   3.362  -1.034   0.292
   1.299  -2.095  -0.730
  -0.228  -2.062  -0.633
  -0.714  -0.656  -0.285
   0.074   0.401  -1.047
  -0.499   1.760  -0.696
  -1.966   1.950  -0.885
  -2.767   0.835  -0.260
  -2.764   0.875   1.278
  -3.236  -0.544   1.674
  -2.920  -1.459   0.471
  -2.214  -0.562  -0.584
A1AA[A@@H]2AA[A@H]3[A@@H]4AAA[A@H]4AA[A@@H]3[A@H]2A1
  -3.838  -1.415  -0.336
  -4.345  -0.004  -0.269
  -3.576   1.052   0.014
  -2.172   0.939   0.370
  -1.356   2.106  -0.183
   0.096   1.967   0.287
   0.676   0.642  -0.206
   2.094   0.460   0.302
   3.120   1.479  -0.208
   4.469   0.724  -0.057
   4.131  -0.787  -0.095
   2.630  -0.858  -0.351
   1.886  -2.013   0.290
   0.403  -1.872  -0.095
  -0.159  -0.525   0.346
  -1.594  -0.376  -0.156
  -2.470  -1.525   0.344
A1AA=A2AA[A@@H]3[A@@H]4AAA[A@@H]4AA[A@@H]3[A@@H]2A1
  -4.071   0.786  -0.313
  -3.957  -0.090   0.914
  -2.892  -1.095   0.928
  -1.862  -0.992   0.091
  -0.819  -2.094   0.096
   0.575  -1.458   0.215
   0.765  -0.438  -0.901
   2.178   0.125  -0.959
   3.189  -1.036  -0.822
   3.984  -0.810   0.473
   3.412   0.444   1.156
   2.553   1.145   0.108
   1.448   2.009   0.658
   0.092   1.333   0.606
  -0.245   0.705  -0.726
  -1.666   0.176  -0.824
  -2.683   1.288  -0.701
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a1aaa2a(a1)A1[A@@H]3AAA[A@H]3A2a2aaaaa12
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a1aaa2a(a1)A1[A@H]3AAA[A@H]3A2a2aaaaa12
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   2.130   1.067  -0.507
   3.042   0.034  -0.428
   2.642  -1.198   0.073
   1.335  -1.388   0.491
   0.414  -0.352   0.412
A1AAA2=A(A1)A=A1[A@H](A2)Aa2aaaaa12
   4.223  -1.197   0.001
   4.584   0.098   0.001
   3.649   1.072   0.000
   2.293   0.716  -0.000
   1.927  -0.618  -0.000
   2.932  -1.572   0.000
   0.645  -0.993  -0.001
  -0.387  -0.182  -0.001
  -0.217   1.229  -0.002
   1.203   1.763  -0.002
  -1.421   1.840   0.004
  -2.486   0.813  -0.001
  -3.872   0.883  -0.000
  -4.621  -0.286   0.001
  -3.997  -1.517   0.001
  -2.610  -1.600  -0.000
  -1.852  -0.444  -0.001
A1A[A@H]2AA[A@H]3AAA[A@@H]3[A@H]2A1
   2.240  -0.955  -0.869
   2.179   0.471  -0.709
   1.538   0.722   0.549
   0.685   1.970   0.517
  -0.518   1.819  -0.250
  -1.292   0.736   0.239
  -2.520   0.455  -0.435
  -2.739  -0.951  -0.160
  -1.461  -1.569   0.114
  -0.488  -0.551  -0.093
   0.732  -0.575   0.811
   1.649  -1.575   0.287
A1AAA2=A(A1)Aa1a(aaa3aaaaa13)[AH+]2
   4.398  -1.353   0.464
   4.734  -0.004  -0.179
   3.728   1.035   0.321
   2.327   0.592  -0.028
   2.008  -0.719  -0.097
   2.975  -1.711   0.137
   0.608  -1.164  -0.432
  -0.386  -0.058  -0.221
   0.028   1.253  -0.153
  -0.899   2.287   0.033
  -2.226   2.023   0.159
  -2.683   0.695   0.103
  -4.049   0.391   0.235
  -4.459  -0.905   0.177
  -3.544  -1.940  -0.007
  -2.215  -1.684  -0.145
  -1.753  -0.357  -0.090
   1.408   1.621  -0.284
a1aaa2AA3(AA[A@H]4AAA[A@@H]34)Aa2a1
   4.055   0.049  -0.378
   3.762   0.977   0.605
   2.466   1.128   1.061
   1.441   0.343   0.530
  -0.003   0.309   0.836
  -0.615  -0.737  -0.053
  -1.266  -1.755   0.721
  -2.557  -1.203   1.065
  -3.025  -0.458  -0.205
  -3.547   0.906   0.186
  -2.699   1.847  -0.245
  -1.618   1.376  -0.911
  -1.702  -0.133  -0.955
   0.508  -1.311  -0.872
   1.739  -0.604  -0.469
   3.056  -0.740  -0.916
A1A[A@H]2[A@H]3A=A[A@H](A3)[A@H]2A1
   2.039   0.014  -0.342
   1.448   1.130   0.095
   0.272   0.749   0.964
  -1.041   1.088   0.193
  -0.757   0.709  -1.263
  -0.752  -0.613  -1.312
  -1.032  -1.102   0.111
  -1.904  -0.027   0.598
   0.271  -0.823   0.921
   1.457  -1.129   0.037
A1AA[A@@]2(A1)[A+]=A[A@H]1A[A@@H]21
  -2.354   0.934  -0.326
  -2.776  -0.364   0.405
  -1.203  -1.329   0.332
  -0.118   0.083  -0.129
  -1.038   0.893  -0.876
   0.402   0.749   1.057
   1.699   0.759   1.052
   2.275   0.087  -0.169
   2.059  -1.414  -0.367
   1.053  -0.400  -0.979
A1AAA2=A(A1)[A@]1(A=AA2)AAa2aaaaa12
   2.391   2.333   0.559
   3.620   1.433   0.389
   3.314   0.071   1.016
   2.102  -0.535   0.349
   1.124   0.249  -0.144
   1.201   1.653  -0.062
  -0.085  -0.364  -0.801
   0.190  -1.785  -1.197
   1.232  -2.456  -0.643
   2.029  -1.877   0.268
  -0.476   0.449  -2.018
  -1.723   0.916  -1.798
  -2.220   0.512  -0.571
  -3.455   0.785   0.018
  -3.693   0.241   1.271
  -2.754  -0.531   1.923
  -1.520  -0.810   1.347
  -1.277  -0.276   0.100
A1=A[A@H]2[A@@H](A1)A[AH+]a1aaaaa21
  -2.809   0.968  -0.750
  -1.574   1.388  -0.618
  -0.909   0.695   0.547
  -1.738  -0.588   0.750
  -3.137  -0.060   0.315
  -1.315  -1.649  -0.269
   0.135  -1.989  -0.091
   1.003  -0.849  -0.034
   2.353  -1.064  -0.282
   3.244  -0.011  -0.229
   2.782   1.264   0.073
   1.435   1.476   0.321
   0.535   0.420   0.269
A1A[A@@H]2A[AH+]3AAA[AH+]3[A@@H]2A1
  -2.603  -0.087  -0.596
  -2.236   0.920   0.204
  -0.990   0.526   0.965
   0.201   1.369   0.461
   0.747   0.564  -0.639
   2.189   0.830  -0.811
   2.877  -0.229   0.072
   1.715  -1.049   0.672
   0.602  -0.771  -0.241
  -0.693  -0.907   0.452
  -1.809  -1.162  -0.536
A1AA[A@@H]2A(A1)AAa1a2[aH]a2aaaaa12
   4.070  -0.537   0.894
   2.921  -1.541   1.057
   2.273  -1.746  -0.311
   1.694  -0.455  -0.851
   2.356   0.749  -0.362
   3.492   0.743   0.350
   1.714   2.049  -0.651
   0.369   2.104   0.083
  -0.359   0.800  -0.117
   0.223  -0.349  -0.531
  -0.713  -1.344  -0.608
  -1.935  -0.858  -0.240
  -3.190  -1.457  -0.151
  -4.238  -0.656   0.267
  -4.066   0.681   0.585
  -2.842   1.298   0.505
  -1.764   0.512   0.085
A1AA[A@@H]2A[AH+]a3aaaaa3[AH+]A2=A1
  -2.979  -1.318  -1.008
  -3.612   0.053  -0.835
  -2.578   1.060  -0.377
  -1.779   0.675   0.846
  -0.638   1.678   1.097
   0.213   1.713  -0.143
   1.271   0.756  -0.098
   2.449   1.139  -0.750
   3.517   0.275  -0.844
   3.446  -0.992  -0.294
   2.295  -1.385   0.362
   1.221  -0.515   0.467
   0.077  -0.945   1.210
  -1.168  -0.668   0.587
  -1.738  -1.530  -0.213
A1[AH2+]A[A@@H]2[A@H](A1)Aa1aaaaa21
  -3.065   0.150  -0.838
  -2.832  -1.209  -0.382
  -1.432  -1.491  -0.154
  -0.731  -0.532   0.782
  -1.209   0.902   0.721
  -2.571   1.171   0.163
  -0.140   1.671   0.090
   0.994   0.857  -0.030
   2.276   1.182  -0.475
   3.264   0.221  -0.503
   2.992  -1.072  -0.094
   1.723  -1.403   0.344
   0.731  -0.444   0.370
a1aaa2AA[A@@]3(A=AAa4a[aH]aa34)a2a1
  -2.582   0.300   1.983
  -3.580  -0.224   1.187
  -3.369  -0.530  -0.149
  -2.092  -0.297  -0.663
  -1.607  -0.512  -1.941
  -0.309  -0.159  -2.056
   0.131   0.352  -0.701
   0.586   1.781  -0.804
   1.735   2.223  -0.247
   2.590   1.448   0.449
   2.428   0.100   0.376
   3.221  -0.861   0.749
   2.595  -2.084   0.459
   1.393  -1.817  -0.104
   1.261  -0.484  -0.170
  -1.087   0.230   0.157
  -1.306   0.537   1.483
A1AAA2=A(A1)a1a(aaa3aaaaa13)[AH+]A2
   2.581  -2.281   0.674
   3.761  -1.730  -0.130
   3.679  -0.229  -0.137
   2.439   0.435  -0.069
   1.269  -0.258  -0.038
   1.285  -1.763   0.054
   0.026   0.421  -0.070
   0.010   1.824  -0.050
  -1.198   2.521   0.063
  -2.384   1.878   0.178
  -2.444   0.472   0.130
  -3.674  -0.190   0.269
  -3.747  -1.533   0.055
  -2.612  -2.246  -0.319
  -1.393  -1.636  -0.401
  -1.260  -0.275  -0.113
   1.175   2.646  -0.106
   2.492   1.940   0.009
a1aaa2AA[A@@]3(A=AAa4[aH]aaa34)a2a1
  -2.587  -0.280  -1.978
  -3.578   0.246  -1.175
  -3.356   0.550   0.159
  -2.081   0.302   0.668
  -1.589   0.507   1.945
  -0.295   0.139   2.054
   0.136  -0.370   0.696
   0.576  -1.805   0.792
   1.724  -2.244   0.225
   2.567  -1.451  -0.467
   2.397  -0.108  -0.374
   3.212   0.890  -0.750
   2.580   2.103  -0.437
   1.418   1.836   0.112
   1.273   0.457   0.165
  -1.084  -0.233  -0.158
  -1.312  -0.533  -1.484
A1A[A@@H]2[A@H]3AA[A@H](A3)[A@H]2A1
   2.523  -0.064   0.126
   1.710  -1.152  -0.096
   0.361  -0.702   0.393
  -0.934  -1.168  -0.310
  -1.984  -0.725   0.785
  -1.812   0.835   0.810
  -0.904   1.159  -0.402
  -1.266  -0.049  -1.336
   0.494   0.756  -0.212
   1.810   1.111   0.241
a1aaa2aa3[A@@H]4AA[A@@H](A4)a3aa2a1
   3.733  -0.699   0.132
   3.734   0.695   0.133
   2.570   1.396   0.052
   1.347   0.709  -0.035
   0.187   1.373  -0.116
  -0.933   0.704  -0.197
  -2.392   1.157  -0.302
  -3.014   0.776   1.078
  -3.032  -0.784   1.072
  -2.393  -1.151  -0.305
  -2.972   0.004  -1.201
  -0.934  -0.700  -0.199
   0.185  -1.371  -0.119
   1.346  -0.709  -0.036
   2.568  -1.398   0.050
A1A[A@H]2[A@H]3AA[A@H](A3)[A@H]2A1
   2.037   0.004   0.404
   1.465  -1.124  -0.032
   0.297  -0.782  -0.929
  -1.020  -1.169  -0.191
  -0.770  -0.767   1.294
  -0.774   0.779   1.286
  -1.024   1.165  -0.204
  -1.967  -0.006  -0.653
   0.295   0.773  -0.936
   1.458   1.127  -0.036
A1A[A@@H]2Aa3aa4AAAa4aa3A[A@@H]2A1
  -3.791   0.362   1.052
  -3.019  -0.746   1.057
  -2.510  -0.967  -0.338
  -1.199  -1.672  -0.463
  -0.002  -0.790  -0.240
   1.228  -1.432  -0.079
   2.353  -0.645   0.103
   3.647  -0.993   0.278
   4.408   0.202   0.006
   3.489   1.276   0.298
   2.254   0.755   0.121
   1.029   1.381  -0.028
  -0.105   0.580  -0.199
  -1.416   1.298  -0.329
  -2.523   0.449  -0.949
  -3.848   0.949  -0.287
A1[AH2+]A[A@H]2[A@H](A1)Aa1aaaaa21
  -3.469   0.143   0.243
  -3.004  -1.191  -0.205
  -1.619  -1.484   0.293
  -0.734  -0.413  -0.297
  -1.152   0.939   0.350
  -2.521   1.265  -0.217
   0.017   1.822  -0.094
   1.194   0.870  -0.054
   2.542   1.158   0.039
   3.423   0.086   0.083
   2.971  -1.219   0.039
   1.618  -1.518  -0.064
   0.732  -0.456  -0.122
A1AAA2=A(A1)Aa1a(aaa3[a+]aaaa13)A2
   4.415   1.309  -0.472
   4.735  -0.034   0.192
   3.722  -1.070  -0.301
   2.323  -0.610   0.030
   2.017   0.705   0.087
   2.994   1.686  -0.152
   0.620   1.168   0.411
  -0.385   0.070   0.211
   0.015  -1.245   0.151
  -0.925  -2.269  -0.028
  -2.248  -1.991  -0.155
  -2.694  -0.658  -0.095
  -4.044  -0.420  -0.222
  -4.418   0.876  -0.163
  -3.541   1.945   0.012
  -2.201   1.714   0.137
  -1.749   0.381   0.086
   1.370  -1.559   0.265
A1A[A@H]2A[AH+]3AAA[AH+]3[A@@H]2A1
  -2.685  -0.386  -0.336
  -2.208   0.881  -0.562
  -0.791   0.791  -0.296
   0.348   1.671   0.015
   1.323   0.718   0.625
   2.478   0.548  -0.274
   2.441  -0.931  -0.719
   0.969  -1.331  -0.439
   0.670  -0.535   0.772
  -0.757  -0.247   0.896
  -1.786  -1.180   0.316
a1aaa2A[A@H]3[AH2+]AA[A@H](A3)a2a1
  -2.858  -0.768   0.154
  -2.934   0.595   0.407
  -1.813   1.383   0.263
  -0.602   0.826  -0.134
   0.569   1.756  -0.307
   1.878   1.001  -0.455
   2.433   0.567   0.837
   1.583  -0.466   1.470
   1.451  -1.676   0.539
   0.773  -1.198  -0.758
   1.697  -0.171  -1.420
  -0.523  -0.527  -0.369
  -1.650  -1.324  -0.233
A1=A[A@H]2[A@H](A1)A[AH+]a1aaaaa21
  -2.988   1.227  -0.244
  -1.768   1.632   0.086
  -0.956   0.442   0.450
  -1.612  -0.704  -0.376
  -3.082  -0.312  -0.179
  -1.146  -1.993   0.279
   0.355  -2.114   0.054
   1.088  -0.868   0.049
   2.465  -0.932  -0.190
   3.234   0.212  -0.229
   2.641   1.457  -0.059
   1.273   1.545   0.158
   0.502   0.404   0.205
A1AA[A@H]2A(A1)AAa1a2[aH]a2aaaaa12
  -4.158   0.339  -0.846
  -3.751   1.643  -0.189
  -2.227   1.675  -0.138
  -1.674   0.484   0.621
  -2.298  -0.786   0.273
  -3.468  -0.881  -0.384
  -1.619  -2.037   0.661
  -0.263  -2.117  -0.050
   0.436  -0.789   0.086
  -0.185   0.374   0.383
   0.730   1.392   0.429
   1.977   0.904   0.160
   3.224   1.519   0.085
   4.306   0.709  -0.216
   4.171  -0.652  -0.435
   2.955  -1.285  -0.369
   1.845  -0.490  -0.066
A1AA2AAa3a([aH]a4aaaaa34)[A@@H]2A1
  -3.846   1.191   0.636
  -3.669  -0.310   0.584
  -2.565  -0.630  -0.121
  -2.055  -1.988  -0.309
  -0.556  -2.087  -0.100
   0.143  -0.762  -0.165
  -0.436   0.433  -0.409
   0.504   1.427  -0.404
   1.734   0.894  -0.149
   2.998   1.470  -0.039
   4.053   0.617   0.233
   3.879  -0.748   0.392
   2.645  -1.343   0.289
   1.562  -0.503   0.013
  -1.919   0.587  -0.644
  -2.472   1.750   0.199
a1aaa2a(a1)AA[A+]1A2=[A+]a2aaaaa12
  -4.378  -0.319  -0.025
  -3.737  -1.542  -0.121
  -2.356  -1.606  -0.120
  -1.620  -0.436  -0.019
  -2.269   0.808   0.104
  -3.654   0.852   0.092
  -1.508   1.964   0.249
  -0.162   2.065  -0.328
   0.522   0.753   0.200
  -0.143  -0.415  -0.029
   0.709  -1.397   0.066
   1.961  -0.906   0.038
   3.211  -1.535   0.118
   4.320  -0.728   0.067
   4.227   0.648  -0.057
   3.006   1.297  -0.141
   1.864   0.504  -0.093
a1aaa2AA[A@]3(A=AAa4[aH]aaa34)a2a1
   2.586   0.260   1.981
   3.578  -0.257   1.172
   3.357  -0.546  -0.165
   2.081  -0.293  -0.671
   1.589  -0.484  -1.950
   0.295  -0.118  -2.055
  -0.136   0.377  -0.692
  -0.576   1.813  -0.774
  -1.724   2.247  -0.203
  -2.569   1.446   0.478
  -2.398   0.105   0.373
  -3.212  -0.897   0.740
  -2.578  -2.107   0.418
  -1.416  -1.834  -0.126
  -1.273  -0.454  -0.169
   1.084   0.232   0.160
   1.311   0.517   1.490
a1aa2A[a+]3a(=Aa2[aH]1)aaa1aaaaa31
   4.468   0.595  -0.020
   3.501   1.501  -0.023
   2.309   0.857  -0.022
   0.853   1.254  -0.024
  -0.114   0.136   0.327
   0.343  -1.131  -0.017
   1.648  -1.421  -0.016
   2.610  -0.537  -0.018
   3.996  -0.602  -0.017
  -0.626  -2.231  -0.014
  -1.927  -1.990  -0.020
  -2.387  -0.743  -0.020
  -3.773  -0.472  -0.022
  -4.201   0.817  -0.026
  -3.303   1.886  -0.027
  -1.955   1.688  -0.026
  -1.446   0.386  -0.022
A1AA[A@H]2A[AH+]a3aaaaa3[AH+]A2=A1
   3.200  -1.416  -0.557
   3.380  -0.023  -1.170
   3.039   0.992  -0.102
   1.688   0.914   0.564
   0.707   1.805  -0.198
  -0.613   1.854   0.516
  -1.523   0.806   0.158
  -2.704   1.095  -0.500
  -3.576   0.072  -0.832
  -3.273  -1.237  -0.505
  -2.098  -1.535   0.162
  -1.224  -0.520   0.502
  -0.044  -0.798   1.268
   1.189  -0.501   0.596
   1.853  -1.514   0.093
A1[A@H]2A[A@@H]3AA[A@H](A2)[A@H]13
   1.622  -0.118   0.891
   1.482  -0.121  -0.673
   0.444  -1.268  -0.865
  -0.518  -1.135   0.342
  -1.766  -0.556  -0.150
  -1.689   0.782  -0.190
  -0.326   1.224   0.316
   0.649   1.179  -0.887
   0.100   0.010   1.212
a1aaa2a(a1)[AH+]Aa1a2[a+]a2aaaaa12
  -4.377  -0.331  -0.020
  -3.733  -1.553  -0.124
  -2.352  -1.615  -0.121
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a1aaa2AA[A@]3(A=AAa4a[aH]aa34)a2a1
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A1AAA2(AA1)Aa1aaaaa1A1AAAA[A@@H]21
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A1AAA2(AA1)Aa1aaaaa1[A@@H]1AA=AA21
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A1AA[A@@]23AAA[A@@H](AA2)[A@@H]3A1
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a1aaa2a(a1)AAA12a2aaaaa2Aa2aaaaa12
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A1AA2=A(A1)a1aaa3AA[AH2+]Aa3a1AA2
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a1aaa2aa3[A@H]4AA[A@H](A4)a3aa2a1
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A1AAA2(AA1)Aa1aaaaa1[A@H]1AA=AA21
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a1aaa2a(a1)AA[a+]1a2[aH]a2aaaaa12
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A1AAA2Aa3[aH]a4aaaaa4a3A[A@@H]2A1
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a1aaa2AAA3=A(a2a1)A1(A=AA3)AA=AA1
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A1AA[A@@H]2A[A@H]3AAA[A@H]3A=A2A1
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A1AA2AAa3a([aH]a4aaaaa34)[A@H]2A1
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   4.051   0.602  -0.258
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A1AA=A2A[A@H]3AAA[A@H]3A[A@@H]2A1
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A1A[A@@H]2Aa3aa4AAAa4aa3A[A@H]2A1
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a1aaa2A=A3a4aaaaa4[AH+]A[A+]3a2a1
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A1AAA2(AA1)Aa1aaaaa1A1AAAA[A@H]21
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A1A[A@@H]2A[A@@H]3A=A[A@@]2(A1)A3
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a1[a+]aa2aa3a(aa2a1)[aH]a1aaaaa31
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A1A[A@@H]2AA3AAA[A@@H]3AA[A@H]2A1
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A1A[A@@H]2AA3AA=AA=A3[A@H](A1)A2
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A1AAA2Aa3[aH]a4aaaaa4a3A[A@H]2A1
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A1AAA2=AA3=AAAA[A@@H]3A[A@@H]2A1
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a1aaa2aa3aaa4aaaa5aaa(a2a1)a3a45
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A1A[A@H]2A[A@@H]3A=A[A@@]2(A1)A3
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A1AA[A@H]2[A@H]3AAA[A@]2(AA1)AA3
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A1AA2Aa3[aH]a4aaaaa4a3A[A@@H]2A1
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A1AAA2=A(A1)[AH+]a1aaaaa1[AH+]A2
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a1aaa2a(a1)AA1(AAAA1)A1=A2A=AAA1
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  -2.433  -2.231   1.329
  -2.862  -2.536  -0.128
  -2.437  -1.253  -0.886
  -1.019   0.646  -0.127
   0.220   1.265  -0.029
   0.297   2.597   0.051
  -0.793   3.339   0.044
  -2.034   2.780  -0.045
  -2.172   1.439  -0.133
A1A[A@H]2AA3AA=AA=A3[A@@H](A1)A2
   1.522  -0.430  -1.467
   2.372   0.608  -0.876
   1.850   1.027   0.491
   0.507   1.731   0.388
  -0.589   0.799   0.120
  -1.735   1.322  -0.381
  -2.899   0.544  -0.459
  -2.847  -0.769  -0.095
  -1.627  -1.304   0.336
  -0.517  -0.523   0.396
   0.796  -1.198   0.727
   1.451  -1.616  -0.599
   1.720  -0.187   1.415
A1AA[A@]23AAA[A@H](AA2)[A@@H]3A1
  -2.633   0.572  -0.501
  -2.529  -0.697   0.350
  -1.319  -1.505  -0.122
  -0.047  -0.699   0.007
   1.074  -1.412  -0.534
   2.337  -0.814  -0.227
   2.339   0.659  -0.645
   1.092   1.338  -0.046
   0.954   0.820   1.383
   0.251  -0.337   1.360
  -0.134   0.654  -0.737
  -1.380   1.418  -0.284
A1AAA2=A(A1)AA1=Aa3aaaaa3[A+]1A2
  -4.561   0.318  -0.283
  -4.405  -1.059   0.370
  -3.012  -1.565   0.115
  -1.933  -0.681  -0.077
  -2.113   0.655  -0.011
  -3.476   1.241   0.277
  -1.076   1.537  -0.196
   0.218   1.049  -0.132
   1.336   1.709  -0.001
   2.366   0.840   0.028
   3.747   1.033   0.154
   4.542  -0.099   0.149
   4.008  -1.370   0.024
   2.645  -1.585  -0.103
   1.824  -0.464  -0.100
   0.474  -0.264   0.152
  -0.583  -1.300  -0.360
A1=A[A@@H]2[A@@H](A1)AAa1aaaaa21
   2.997  -1.207   0.247
   1.775  -1.625  -0.063
   0.953  -0.447  -0.440
   1.614   0.701   0.379
   3.074   0.316   0.130
   1.138   1.988  -0.272
  -0.323   2.032  -0.046
  -1.090   0.860  -0.026
  -2.462   0.948   0.174
  -3.236  -0.193   0.212
  -2.649  -1.435   0.052
  -1.285  -1.534  -0.153
  -0.505  -0.399  -0.200
A1AAA2=Aa3aaaaa3[AH+]A[A@@H]2A1
  -3.968   0.169  -0.404
  -3.616  -0.980   0.546
  -2.318  -1.621   0.056
  -1.206  -0.578   0.059
  -0.035  -1.032   0.326
   1.227  -0.630   0.136
   2.212  -1.556  -0.231
   3.520  -1.159  -0.399
   3.886   0.162  -0.208
   2.930   1.099   0.142
   1.613   0.721   0.301
   0.618   1.675   0.658
  -0.505   1.833  -0.302
  -1.542   0.763  -0.229
  -2.821   1.134  -0.448
A1AA[A@@H]2AAa3aaaaa3[AH+]A2=A1
  -2.982   1.323   1.000
  -3.614  -0.050   0.839
  -2.579  -1.060   0.389
  -1.780  -0.685  -0.837
  -0.639  -1.689  -1.079
   0.240  -1.709   0.114
   1.270  -0.755   0.109
   2.448  -1.131   0.763
   3.516  -0.265   0.850
   3.443   0.997   0.290
   2.292   1.383  -0.370
   1.219   0.511  -0.468
   0.075   0.933  -1.215
  -1.171   0.661  -0.589
  -1.742   1.529   0.203
A1=A[A@H]2[A@@H](A1)AAa1aaaaa21
   2.810   0.957   0.751
   1.576   1.379   0.619
   0.911   0.694  -0.550
   1.734  -0.594  -0.750
   3.135  -0.074  -0.313
   1.302  -1.652   0.270
  -0.128  -1.926   0.093
  -1.007  -0.849   0.033
  -2.362  -1.064   0.280
  -3.244  -0.024   0.230
  -2.779   1.262  -0.072
  -1.419   1.471  -0.320
  -0.534   0.423  -0.271
a1aa2Aa3a(=Aa2[aH]1)aaa1aaaaa31
  -4.503   0.673  -0.001
  -3.511   1.531   0.000
  -2.317   0.825   0.001
  -0.860   1.229   0.001
   0.113   0.127   0.001
  -0.348  -1.171   0.001
  -1.628  -1.451   0.000
  -2.614  -0.528   0.000
  -3.979  -0.627  -0.001
   0.644  -2.263   0.000
   1.924  -1.986   0.000
   2.376  -0.706   0.000
   3.753  -0.450  -0.001
   4.210   0.848  -0.001
   3.316   1.908  -0.001
   1.956   1.675   0.000
   1.474   0.373   0.000
A1AAa2a(A1)[aH]a1[AH+]AAA[a+]21
   3.348   0.190   0.039
   2.987  -1.104   0.013
   1.685  -1.460  -0.018
   0.671  -0.406  -0.031
   1.097   0.916  -0.009
   2.446   1.187   0.023
  -0.027   1.689  -0.025
  -1.100   0.851  -0.058
  -2.466   1.110   0.258
  -3.402   0.124  -0.405
  -2.977  -1.135   0.362
  -1.578  -1.562  -0.094
  -0.685  -0.398  -0.061
a1aaa2aa3a(aa2a1)[aH+]a1aaaaa31
  -4.543   0.266   0.011
  -4.312  -1.034  -0.031
  -3.092  -1.541  -0.042
  -1.972  -0.677  -0.010
  -0.664  -1.167  -0.020
   0.397  -0.279   0.014
   0.174   1.116   0.059
  -1.115   1.611   0.069
  -2.199   0.726   0.036
  -3.531   1.182   0.045
   1.399   1.711  -0.270
   2.429   0.815   0.058
   3.813   0.949   0.068
   4.617  -0.171   0.034
   4.055  -1.442  -0.010
   2.680  -1.592  -0.021
   1.862  -0.466   0.008
A1A[A@@H]2A[A@H]3A=A[A@]2(A1)A3
  -2.346  -0.182  -0.226
  -1.778   1.004   0.158
  -0.417   0.719   0.729
   0.712   1.618   0.192
   1.557   0.604  -0.646
   2.132  -0.418   0.341
   1.123  -1.204   0.734
  -0.058  -0.642   0.027
  -1.396  -1.307  -0.059
   0.473  -0.192  -1.249
a1aaa2a(a1)[AH+]Aa1a2aa2aaaaa12
  -4.377  -0.331  -0.020
  -3.733  -1.553  -0.124
  -2.352  -1.615  -0.121
  -1.618  -0.445  -0.008
  -2.269   0.797   0.123
  -3.654   0.839   0.108
  -1.542   2.016   0.321
  -0.163   2.061  -0.295
   0.536   0.783  -0.128
  -0.141  -0.421  -0.015
   0.712  -1.403   0.075
   1.964  -0.910   0.053
   3.214  -1.537   0.131
   4.322  -0.729   0.089
   4.227   0.648  -0.024
   3.006   1.296  -0.106
   1.865   0.501  -0.067
A1AAA2(AA1)Aa1aaaaa1A1=A2AAA=A1
   3.674   1.505   0.561
   3.445   0.965  -0.852
   2.596  -0.305  -0.782
   1.244   0.019  -0.139
   1.477   0.555   1.277
   2.325   1.826   1.208
   0.530   1.083  -0.971
  -0.882   1.272  -0.484
  -1.464   2.523  -0.503
  -2.778   2.682  -0.099
  -3.517   1.590   0.322
  -2.942   0.335   0.353
  -1.615   0.174  -0.032
  -0.968  -1.157   0.001
   0.414  -1.233  -0.066
   1.024  -2.497  -0.052
   0.237  -3.593   0.028
  -1.116  -3.459   0.118
  -1.693  -2.276   0.107
A1AAA2=AA3=AAAA[A@@H]3A[A@H]2A1
   3.676   0.753  -0.143
   3.512  -0.686  -0.647
   2.494  -1.398   0.232
   1.182  -0.647   0.227
   0.041  -1.380   0.429
  -1.195  -0.738   0.286
  -2.203  -1.389  -0.246
  -3.565  -0.790  -0.449
  -3.420   0.714  -0.712
  -2.597   1.298   0.415
  -1.255   0.694   0.730
  -0.152   1.461  -0.006
   1.145   0.688   0.031
   2.331   1.424  -0.147
A1AA=A2Aa3aaaaa3[AH+]A[A@@H]2A1
   3.380  -0.031  -1.165
   3.199  -1.420  -0.543
   1.853  -1.515   0.107
   1.189  -0.498   0.604
  -0.041  -0.766   1.216
  -1.224  -0.517   0.510
  -2.098  -1.535   0.177
  -3.273  -1.241  -0.492
  -3.576   0.066  -0.827
  -2.704   1.090  -0.502
  -1.524   0.805   0.158
  -0.613   1.856   0.509
   0.707   1.803  -0.205
   1.688   0.917   0.563
   3.038   0.990  -0.103
A1AAA2=A(A1)Aa1a(aaa3aaaaa13)A2
  -4.290   1.268  -0.305
  -4.574  -0.046  -0.349
  -3.619  -0.969  -0.142
  -2.324  -0.587   0.120
  -2.017   0.737   0.166
  -3.033   1.685  -0.053
  -0.614   1.196   0.448
   0.359   0.068   0.233
  -0.071  -1.226   0.182
   0.842  -2.272  -0.024
   2.169  -2.028  -0.176
   2.645  -0.706  -0.127
   4.011  -0.416  -0.281
   4.436   0.876  -0.223
   3.535   1.919  -0.015
   2.204   1.675   0.136
   1.728   0.354   0.082
  -1.385  -1.526   0.329
a1aaa2A[A@@H]3AAA[A@@H](A3)a2a1
   2.787  -0.876   0.181
   2.940   0.472   0.450
   1.870   1.331   0.298
   0.637   0.845  -0.125
  -0.393   1.720  -0.263
  -1.715   1.172  -0.307
  -2.077   0.622   0.987
  -1.984  -0.670   1.306
  -1.539  -1.730   0.339
  -0.833  -1.073  -0.853
  -1.737   0.053  -1.374
   0.486  -0.505  -0.393
   1.562  -1.362  -0.240
A1AA2Aa3[aH]a4aaaaa4a3A[A@H]2A1
   4.245   0.459   0.568
   3.592  -0.710   0.570
   2.444  -0.684  -0.107
   1.449  -1.760  -0.251
   0.089  -1.101  -0.133
  -1.117  -1.745  -0.055
  -2.124  -0.827   0.029
  -3.508  -0.964   0.127
  -4.249   0.203   0.194
  -3.659   1.457   0.167
  -2.299   1.621   0.072
  -1.526   0.458   0.003
  -0.096   0.235  -0.098
   0.994   1.277  -0.145
   2.270   0.650  -0.719
   3.497   1.433  -0.216
a1aaa2AA3AAa4aaaaa4[A@@H]3Aa2a1
  -4.286  -1.395  -0.152
  -4.691  -0.085   0.036
  -3.746   0.934   0.107
  -2.389   0.620  -0.004
  -1.355   1.664   0.092
  -0.058   1.318   0.281
   0.931   2.391   0.280
   2.180   2.026  -0.494
   2.628   0.621  -0.212
   3.964   0.306  -0.430
   4.433  -0.973  -0.193
   3.555  -1.951   0.268
   2.228  -1.632   0.483
   1.762  -0.344   0.245
   0.306  -0.069   0.508
  -0.531  -1.020  -0.349
  -1.994  -0.708  -0.199
  -2.941  -1.705  -0.267
A1AAA2=A(A1)AA1=A(A2)Aa2aaaaa12
  -4.203  -1.166  -0.223
  -4.523   0.140  -0.285
  -3.574   1.083  -0.137
  -2.235   0.700   0.081
  -1.931  -0.625   0.142
  -2.934  -1.556  -0.016
  -0.642  -1.075   0.335
   0.396  -0.183   0.190
   0.180   1.171   0.141
  -1.194   1.778   0.250
   1.412   1.843  -0.020
   2.476   0.816  -0.070
   3.846   0.915  -0.212
   4.570  -0.282  -0.217
   3.952  -1.503  -0.086
   2.566  -1.619   0.057
   1.835  -0.442   0.063
A1AAA2(A1)[A+]=A[A@H]1A[A@@H]21
  -2.258  -0.515   0.769
  -2.435   0.469  -0.405
  -1.176   0.436  -1.113
  -0.226  -0.027  -0.139
  -0.914  -1.025   0.631
   0.231   1.075   0.715
   1.515   1.228   0.637
   2.158   0.239  -0.302
   2.100  -1.252   0.035
   1.001  -0.632  -0.831
A1A[A@H]2A[AH+]a3aaaaa3[A@H]2A1
   2.255   1.224   1.029
   2.226  -0.320   0.982
   1.942  -0.588  -0.516
   1.239  -1.923  -0.699
   0.016  -1.996   0.166
  -0.838  -0.852   0.064
  -2.155  -1.004   0.483
  -3.025   0.066   0.425
  -2.581   1.286  -0.053
  -1.274   1.437  -0.468
  -0.390   0.367  -0.412
   1.025   0.592  -0.874
   1.554   1.706  -0.125
A1[AH2+]Aa2aa3a(aaa4aaaa34)a2A1
   3.964   0.962   0.428
   4.318  -0.223  -0.379
   3.478  -1.376   0.025
   2.050  -0.928   0.017
   0.583  -1.921   0.034
  -0.618  -0.616   0.007
   0.157   0.546  -0.015
  -0.599   1.815  -0.040
  -1.914   1.793  -0.041
  -2.614   0.652  -0.020
  -3.915   0.393  -0.017
  -4.118  -0.875   0.007
  -3.001  -1.517   0.021
  -1.976  -0.559   0.004
   1.605   0.347  -0.008
   2.605   1.500  -0.028
A1=[A+]A[a+]2a(A1)[aH]a1aaaaa21
  -3.323   0.198  -0.141
  -3.047  -1.114  -0.147
  -1.620  -1.517   0.141
  -0.675  -0.397   0.081
  -1.066   0.866   0.063
  -2.410   1.211   0.090
   0.012   1.695   0.012
   1.130   0.897  -0.008
   2.487   1.190  -0.060
   3.363   0.116  -0.066
   2.917  -1.194  -0.023
   1.571  -1.510   0.028
   0.667  -0.441   0.036
A1=A[A@@H]2[A@H](A1)AAa1aaaaa21
   2.794   0.970  -0.761
   1.560   1.387  -0.614
   0.909   0.692   0.558
   1.743  -0.589   0.750
   3.136  -0.058   0.300
   1.311  -1.651  -0.265
  -0.116  -1.935  -0.077
  -0.997  -0.854  -0.040
  -2.345  -1.070  -0.296
  -3.238  -0.020  -0.238
  -2.782   1.253   0.077
  -1.437   1.466   0.332
  -0.533   0.414   0.275
A1AAA2=A(A1)a1a(AA2)aaa2aaaaa12
  -2.686  -2.045   0.966
  -3.808  -1.657  -0.005
  -3.655  -0.201  -0.356
  -2.400   0.422  -0.328
  -1.263  -0.271  -0.038
  -1.344  -1.739   0.294
  -0.013   0.395  -0.014
  -0.001   1.793   0.150
  -1.215   2.468   0.172
  -2.319   1.904  -0.618
   1.200   2.487   0.284
   2.393   1.842   0.274
   2.460   0.444   0.106
   3.642  -0.178   0.121
   3.743  -1.463  -0.117
   2.622  -2.237  -0.392
   1.378  -1.663  -0.387
   1.268  -0.296  -0.105
A1AA=A2Aa3aaaaa3[AH+]A[A@H]2A1
  -3.611  -0.044   0.833
  -2.979   1.329   0.993
  -1.738   1.533   0.195
  -1.168   0.664  -0.596
   0.073   0.906  -1.165
   1.221   0.513  -0.475
   2.295   1.383  -0.379
   3.447   0.996   0.281
   3.518  -0.265   0.843
   2.449  -1.130   0.756
   1.271  -0.754   0.102
   0.213  -1.710   0.156
  -0.638  -1.687  -1.085
  -1.779  -0.682  -0.843
  -2.577  -1.055   0.384
A1AA[A@H]2AAa3aaaaa3[AH+]A2=A1
   3.196  -1.411  -0.567
   3.378  -0.013  -1.169
   3.039   0.993  -0.091
   1.689   0.911   0.574
   0.708   1.810  -0.180
  -0.596   1.806   0.490
  -1.524   0.810   0.169
  -2.704   1.106  -0.486
  -3.577   0.087  -0.825
  -3.276  -1.225  -0.511
  -2.101  -1.530   0.154
  -1.226  -0.519   0.502
  -0.045  -0.805   1.264
   1.188  -0.504   0.594
   1.850  -1.513   0.082
A1A[A@H]2A[A@H]3A=A[A@]2(A1)A3
  -2.305   0.138  -0.220
  -1.617  -1.042  -0.371
  -0.407  -0.943   0.464
   0.953  -1.521   0.163
   1.865  -0.248   0.221
   1.617   0.381  -1.156
   0.387   0.869  -1.093
  -0.092   0.600   0.322
  -1.477   1.105   0.566
   1.079   0.660   1.101
A1=A[A@H]2[A@H](A1)AAa1aaaaa21
   2.999   1.212   0.240
   1.778   1.625  -0.077
   0.955   0.442  -0.438
   1.612  -0.712   0.377
   3.076  -0.314   0.144
   1.131  -1.995  -0.275
  -0.330  -2.034  -0.045
  -1.092  -0.860  -0.025
  -2.466  -0.944   0.169
  -3.235   0.201   0.207
  -2.644   1.442   0.055
  -1.279   1.536  -0.144
  -0.502   0.398  -0.192
[AH2+]1AA[A+]2A(=Aa3aaaaa23)A1
  -3.334   0.109  -0.355
  -2.984  -1.082   0.450
  -1.605  -1.590   0.011
  -0.651  -0.389  -0.325
  -1.069   0.851   0.055
  -0.028   1.632   0.064
   1.094   0.887   0.036
   2.449   1.235   0.032
   3.366   0.193  -0.002
   2.965  -1.138  -0.030
   1.629  -1.500  -0.025
   0.693  -0.472   0.009
  -2.521   1.270   0.074
a1aaa2AA3AAa4aaaaa4[A@H]3Aa2a1
   4.286   1.397   0.130
   4.692   0.085  -0.050
   3.746  -0.935  -0.107
   2.390  -0.622   0.016
   1.356  -1.665  -0.080
   0.058  -1.318  -0.271
  -0.930  -2.392  -0.279
  -2.186  -2.028   0.484
  -2.632  -0.622   0.201
  -3.970  -0.308   0.409
  -4.434   0.974   0.182
  -3.551   1.956  -0.259
  -2.223   1.636  -0.472
  -1.760   0.346  -0.240
  -0.304   0.070  -0.496
   0.532   1.017   0.367
   1.996   0.706   0.211
   2.941   1.705   0.261
A1A2A[AH+]3A[AH+]1A[AH+](A2)A3
   1.317  -0.740  -0.892
   0.106  -0.026  -1.510
  -1.181  -0.725  -1.050
  -1.252  -0.681   0.426
  -0.086  -1.379   1.003
   1.165  -0.701   0.600
   1.139   0.701   1.057
  -0.024   1.405   0.479
   0.082   1.420  -0.995
  -1.269   0.722   0.884
a1aaa2aa3a(aa2a1)[aH]a1aaaaa31
   4.540  -0.268   0.000
   4.301   1.038   0.000
   3.088   1.538   0.001
   1.975   0.680  -0.005
   0.664   1.171   0.001
  -0.396   0.285   0.001
  -0.172  -1.111   0.000
   1.117  -1.607   0.000
   2.201  -0.724   0.001
   3.533  -1.183   0.000
  -1.403  -1.746   0.000
  -2.427  -0.813   0.000
  -3.811  -0.946  -0.001
  -4.613   0.176   0.000
  -4.052   1.443   0.000
  -2.681   1.595   0.000
  -1.861   0.470   0.001
A1AA=A2AA3=A(AA=AA3)A[A@@H]2A1
   3.412  -0.747   0.646
   3.561   0.764   0.435
   2.200   1.379   0.274
   1.178   0.757  -0.244
  -0.058   1.413  -0.353
  -1.199   0.672  -0.123
  -1.156  -0.679   0.018
  -2.369  -1.377   0.217
  -3.526  -0.702   0.279
  -3.553   0.608   0.153
  -2.408   1.317  -0.049
   0.132  -1.458  -0.017
   1.218  -0.665  -0.748
   2.563  -1.285  -0.483
A1AA[A@@H]2AAa3aaaaa3[A@@H]2A1
   2.767   1.490  -0.567
   3.438   0.130  -0.372
   2.871  -0.528   0.888
   1.365  -0.709   0.753
   1.036  -1.667  -0.394
  -0.436  -2.061  -0.279
  -1.304  -0.841  -0.108
  -2.669  -0.988  -0.323
  -3.522   0.086  -0.175
  -3.016   1.320   0.189
  -1.661   1.469   0.400
  -0.802   0.389   0.251
   0.670   0.623   0.491
   1.264   1.288  -0.754
A1AAA2=Aa3aaaaa3[AH+]A[A@H]2A1
  -3.991  -0.217   0.142
  -3.518   1.211   0.432
  -2.348   1.522  -0.501
  -1.217   0.538  -0.241
  -0.033   0.988  -0.454
   1.218   0.613  -0.163
   2.180   1.575   0.171
   3.489   1.211   0.396
   3.879  -0.114   0.296
   2.947  -1.086  -0.018
   1.629  -0.740  -0.232
   0.662  -1.726  -0.581
  -0.508  -1.832   0.326
  -1.550  -0.785   0.124
  -2.836  -1.158   0.308
a1aaa2A=a3a4aaaaa4aa[a+]3a2a1
   4.244   0.702   0.034
   4.368  -0.680   0.019
   3.259  -1.478   0.009
   1.984  -0.901   0.013
   0.732  -1.418   0.006
  -0.148  -0.445   0.015
  -1.620  -0.427   0.012
  -2.368  -1.601  -0.002
  -3.745  -1.530  -0.004
  -4.387  -0.299   0.008
  -3.666   0.873   0.023
  -2.269   0.827   0.025
  -1.526   1.961   0.044
  -0.218   1.934   0.041
   0.500   0.694  -0.316
   1.859   0.499   0.028
   2.998   1.293   0.038
A1AA[AH+]2AAa3aaaaa3[A@@H]2A1
   2.854   1.629   0.016
   3.488   0.329  -0.487
   2.819  -0.863   0.203
   1.374  -0.848  -0.118
   0.715  -2.047   0.440
  -0.667  -2.161  -0.205
  -1.401  -0.849  -0.092
  -2.773  -0.841  -0.293
  -3.488   0.340  -0.203
  -2.822   1.527   0.091
  -1.454   1.514   0.292
  -0.738   0.313   0.181
   0.745   0.364   0.433
   1.346   1.593  -0.252
a1aaa2a(a1)Aa1aaaa3[aH]aa2a13
  -3.902  -0.573   0.000
  -3.730   0.800   0.003
  -2.459   1.348   0.003
  -1.339   0.514   0.000
  -1.508  -0.888  -0.001
  -2.808  -1.419  -0.002
  -0.353  -1.807  -0.000
   0.998  -1.242  -0.005
   2.181  -1.992   0.002
   3.404  -1.312   0.003
   3.493   0.065   0.001
   2.329   0.836   0.000
   1.977   2.160  -0.001
   0.572   2.276  -0.002
   0.021   1.085  -0.001
   1.126   0.146   0.000
A1A=Aa2[aH]a3aa4aaaaa4aa3a2A1
   4.027  -1.345  -0.001
   4.498  -0.075  -0.001
   3.709   0.962  -0.001
   2.373   0.826   0.000
   1.350   1.738  -0.001
   0.127   1.097   0.005
  -1.110   1.553   0.000
  -2.138   0.696   0.000
  -3.464   1.162  -0.001
  -4.494   0.272  -0.001
  -4.255  -1.101  -0.001
  -2.986  -1.591   0.000
  -1.895  -0.702   0.000
  -0.639  -1.158   0.001
   0.367  -0.303   0.000
   1.827  -0.462   0.000
   2.695  -1.575   0.000
A1[AH2+]Aa2a(A1)[aH]a1aaaaa21
   3.392  -0.151  -0.414
   3.027   1.044   0.380
   1.710   1.564  -0.057
   0.721   0.427  -0.016
   1.079  -0.877   0.030
   2.521  -1.330   0.038
  -0.039  -1.664   0.062
  -1.156  -0.880   0.034
  -2.515  -1.191   0.046
  -3.401  -0.128   0.007
  -2.974   1.189  -0.043
  -1.643   1.524  -0.056
  -0.725   0.471  -0.017
a1aaa2A=A3a4aaaaa4AA[A+]3a2a1
   4.227   0.648  -0.057
   4.320  -0.728   0.067
   3.211  -1.535   0.118
   1.961  -0.906   0.038
   0.709  -1.397   0.066
  -0.143  -0.415  -0.029
  -1.620  -0.436  -0.019
  -2.356  -1.606  -0.120
  -3.737  -1.542  -0.121
  -4.378  -0.319  -0.025
  -3.654   0.852   0.092
  -2.269   0.808   0.104
  -1.508   1.964   0.249
  -0.162   2.065  -0.328
   0.522   0.753   0.200
   1.864   0.504  -0.093
   3.006   1.297  -0.141
A1AA2=AA3=A(AAa4aaaaa34)AA2A1
   4.864   0.249   0.071
   3.675   1.579   0.154
   2.195   0.592   0.040
   0.937   0.917   0.042
  -0.085   0.026  -0.054
   0.166  -1.288  -0.178
  -0.953  -2.281  -0.317
  -2.160  -1.862   0.518
  -2.508  -0.423   0.243
  -3.823  -0.007   0.255
  -4.131   1.320   0.012
  -3.124   2.236  -0.237
  -1.805   1.829  -0.254
  -1.493   0.494  -0.019
   1.603  -1.751  -0.179
   2.657  -0.706  -0.060
   3.979  -0.916  -0.045
A1[AH2+]Aa2aa3aaa4aaaa4a3a2A1
  -2.934  -1.970   0.437
  -3.832  -1.131  -0.382
  -3.691   0.292   0.013
  -2.232   0.625   0.011
  -1.466   2.221   0.022
   0.232   1.702   0.010
   1.399   2.342   0.011
   2.547   1.706   0.002
   2.601   0.338  -0.011
   3.621  -0.576  -0.023
   3.073  -1.768  -0.033
   1.788  -1.671  -0.028
   1.443  -0.407  -0.014
   0.145   0.302  -0.001
  -1.204  -0.254  -0.001
  -1.487  -1.754  -0.013
[AH2+]1AAa2a(A1)[aH]a1aaaaa21
  -3.377  -0.125   0.401
  -3.061   1.084  -0.393
  -1.680   1.603   0.031
  -0.721   0.440   0.016
  -1.109  -0.851  -0.040
  -2.560  -1.272  -0.063
  -0.009  -1.658  -0.057
   1.136  -0.892  -0.023
   2.492  -1.201  -0.023
   3.426  -0.189   0.012
   3.027   1.140   0.053
   1.701   1.467   0.059
   0.736   0.458   0.023
a1aaa2[aH]a3=[A+]A=A[a+]3a2a1
  -2.758   1.094  -0.029
  -3.121  -0.243  -0.008
  -2.152  -1.226   0.002
  -0.809  -0.875  -0.009
   0.364  -1.622  -0.004
   1.432  -0.746  -0.028
   2.746  -0.693  -0.043
   3.141   0.596  -0.066
   2.030   1.376  -0.066
   1.000   0.416   0.304
  -0.444   0.472  -0.026
  -1.425   1.453  -0.031
a1aaa2A[A@H]3AAA[A@H](A3)a2a1
   2.831  -0.779  -0.110
   2.925   0.568  -0.394
   1.798   1.383  -0.278
   0.572   0.828   0.128
  -0.499   1.648   0.253
  -1.795   1.079   0.407
  -2.371   0.606  -0.922
  -1.544  -0.545  -1.492
  -1.489  -1.691  -0.477
  -0.814  -1.165   0.801
  -1.722  -0.083   1.401
   0.494  -0.527   0.394
   1.620  -1.323   0.286
A1AA[A@@H]2AAa3aaaaa3[A@H]2A1
  -2.877  -1.590  -0.149
  -3.480  -0.395   0.577
  -2.868   0.929   0.116
  -1.357   0.876   0.122
  -0.702   2.126  -0.460
   0.737   2.191   0.057
   1.410   0.845   0.035
   2.777   0.814   0.292
   3.467  -0.379   0.287
   2.799  -1.561   0.024
   1.442  -1.535  -0.231
   0.750  -0.336  -0.223
  -0.737  -0.357  -0.509
  -1.363  -1.626   0.062
A1AA[A+]2[A@@H](A1)Aa1aaaaa21
   3.278  -0.084   0.366
   2.954   1.259  -0.218
   1.453   1.531  -0.307
   0.729   0.351   0.241
   1.181  -0.856  -0.465
   2.458  -1.155   0.196
   0.071  -1.852  -0.072
  -1.138  -0.915   0.005
  -2.484  -1.202  -0.055
  -3.365  -0.127  -0.019
  -2.910   1.172   0.072
  -1.560   1.473   0.143
  -0.661   0.405   0.119
A1AA=A2AA3=A(AA=AA3)A[A@H]2A1
  -3.415  -0.747   0.642
  -3.564   0.764   0.426
  -2.203   1.379   0.270
  -1.178   0.756  -0.242
   0.058   1.413  -0.348
   1.199   0.672  -0.119
   1.156  -0.679   0.023
   2.370  -1.377   0.217
   3.528  -0.702   0.270
   3.555   0.608   0.143
   2.408   1.319  -0.042
  -0.131  -1.457  -0.008
  -1.216  -0.666  -0.744
  -2.561  -1.287  -0.484
A1AA[A@@H]2AA[AH2+]A[A@@H]2A1
   2.213   0.555  -0.518
   2.078  -0.969  -0.512
   0.595  -1.344  -0.509
  -0.073  -0.779   0.747
  -1.564  -1.134   0.724
  -2.213  -0.496  -0.506
  -2.050   0.970  -0.453
  -0.619   1.331  -0.471
   0.074   0.745   0.760
   1.555   1.122   0.741
A1A[A@@H]2A[AH2+]A[A@H](A1)A2
  -1.280   0.013   0.985
  -1.245  -1.250   0.235
  -0.012  -1.248  -0.674
   1.243  -1.231   0.201
   1.234  -0.016   1.043
   1.286   1.192   0.193
   0.023   1.248  -0.668
  -1.210   1.289   0.242
  -0.041   0.003  -1.557
A1A[A@@H]2AAa3aaaaa3[A@@H]2A1
   2.291   1.175  -1.032
   2.232  -0.367  -0.957
   1.921  -0.606   0.541
   1.149  -1.906   0.716
   0.017  -1.911  -0.154
  -0.821  -0.844  -0.075
  -2.138  -1.000  -0.492
  -3.016   0.063  -0.430
  -2.581   1.285   0.049
  -1.274   1.442   0.464
  -0.386   0.377   0.404
   1.029   0.605   0.870
   1.580   1.691   0.100
A1=[A+]A[A+]2A(=Aa3aaaaa23)A1
   3.317  -0.211   0.095
   3.069   1.105   0.089
   1.646   1.543  -0.183
   0.668   0.394   0.243
   1.060  -0.877  -0.079
   0.007  -1.644  -0.022
  -1.103  -0.878  -0.006
  -2.462  -1.206   0.051
  -3.362  -0.155   0.051
  -2.948   1.165  -0.004
  -1.608   1.513  -0.060
  -0.684   0.476  -0.062
   2.403  -1.228  -0.107
A1AAA2=AA3=A(AAAA3)A[A@@H]2A1
  -3.744   0.649  -0.336
  -3.653  -0.738   0.309
  -2.430  -1.459  -0.259
  -1.190  -0.645   0.013
  -0.000  -1.296   0.185
   1.190  -0.645   0.011
   1.244   0.702   0.089
   2.459   1.390  -0.082
   3.744   0.649  -0.336
   3.654  -0.739   0.305
   2.430  -1.459  -0.260
  -0.001   1.505   0.359
  -1.244   0.702   0.086
  -2.458   1.389  -0.088
a1aaa2[A@@H]3AA[A@@H](A3)a2a1
  -2.558  -0.694  -0.157
  -2.561   0.688  -0.162
  -1.375   1.386  -0.005
  -0.195   0.697   0.155
   1.251   1.158   0.347
   1.988   0.764  -0.994
   1.977  -0.784  -0.982
   1.255  -1.147   0.354
   1.782   0.010   1.281
  -0.193  -0.692   0.160
  -1.370  -1.386   0.004
A1AA[A@H]2AAa3aaaaa3[A@@H]2A1
  -2.872   1.595  -0.143
  -3.487   0.395   0.563
  -2.871  -0.927   0.102
  -1.359  -0.876   0.126
  -0.701  -2.126  -0.454
   0.737  -2.191   0.062
   1.410  -0.846   0.037
   2.778  -0.813   0.293
   3.468   0.380   0.284
   2.800   1.560   0.018
   1.443   1.534  -0.236
   0.750   0.335  -0.224
  -0.738   0.357  -0.507
  -1.359   1.622   0.082
A1AAA2=A(A1)Aa1aaaaa1[AH+]A2
  -3.258  -1.303  -0.633
  -3.873   0.099  -0.536
  -2.762   1.105  -0.522
  -1.475   0.804  -0.016
  -1.218  -0.412   0.496
  -2.304  -1.473   0.548
  -0.022  -0.796   1.009
   1.211  -0.577   0.405
   2.010  -1.613  -0.045
   3.248  -1.325  -0.595
   3.682  -0.015  -0.690
   2.876   1.023  -0.256
   1.627   0.739   0.274
   0.753   1.799   0.680
  -0.494   1.947  -0.121
A1AAA2=AA3=A(AAAA3)A[A@H]2A1
   3.762   0.618   0.109
   3.460  -0.734   0.762
   2.443  -1.478  -0.106
   1.195  -0.645  -0.250
  -0.008  -1.280  -0.396
  -1.178  -0.638  -0.096
  -1.229   0.710  -0.084
  -2.424   1.388   0.214
  -3.690   0.636   0.522
  -3.658  -0.713  -0.204
  -2.398  -1.467   0.224
  -0.000   1.524  -0.392
   1.252   0.704  -0.237
   2.475   1.376  -0.070
a1aa[a+]2a(=[A+]a3aaaaa23)a1
   3.430   0.137   0.039
   2.969  -1.172   0.051
   1.619  -1.445   0.049
   0.674  -0.374  -0.310
   1.079   0.871   0.021
   0.011   1.648   0.009
  -1.107   0.883   0.012
  -2.474   1.183   0.004
  -3.393   0.173   0.011
  -2.986  -1.154   0.022
  -1.644  -1.474   0.036
  -0.696  -0.462   0.029
   2.512   1.187   0.024
A1A[A@@H]2AAa3aaaaa3[A@H]2A1
   3.040  -1.160  -0.038
   3.080   0.356  -0.223
   1.604   0.727  -0.383
   1.131   1.986   0.320
  -0.362   2.141   0.007
  -1.112   0.835   0.028
  -2.490   0.883  -0.144
  -3.239  -0.273  -0.184
  -2.619  -1.506  -0.049
  -1.247  -1.561   0.137
  -0.498  -0.401   0.182
   0.967  -0.452   0.409
   1.740  -1.573  -0.056
a1aaa2Aa3a(aaa4aaaaa34)Aa2a1
  -4.764   0.024   0.004
  -4.386   1.352  -0.001
  -3.045   1.702  -0.003
  -2.067   0.713   0.000
  -0.636   1.078  -0.001
   0.393   0.021   0.004
   0.020  -1.325  -0.008
   1.004  -2.331  -0.003
   2.345  -2.006   0.002
   2.745  -0.661   0.002
   4.111  -0.317   0.007
   4.484   0.988   0.001
   3.520   2.013  -0.004
   2.168   1.707  -0.003
   1.765   0.365   0.002
  -1.411  -1.695  -0.013
  -2.444  -0.644   0.006
  -3.799  -0.983   0.007
A1AAA2=A(A1)[AH+]a1aaaaa1AA2
  -3.255  -1.288  -0.663
  -3.871   0.111  -0.539
  -2.761   1.118  -0.504
  -1.475   0.809  -0.003
  -1.216  -0.417   0.485
  -2.301  -1.481   0.515
  -0.021  -0.862   1.083
   1.212  -0.577   0.393
   2.013  -1.603  -0.077
   3.251  -1.303  -0.620
   3.684   0.008  -0.689
   2.876   1.037  -0.235
   1.628   0.742   0.288
   0.734   1.745   0.651
  -0.495   1.954  -0.084
a1aaa2AAA3=A(Aa4aaaa4A3)a2a1
  -3.238  -1.979   0.213
  -4.167  -0.957   0.114
  -3.756   0.353  -0.055
  -2.406   0.644  -0.125
  -1.962   1.916  -0.287
  -0.738   2.264   0.360
   0.329   1.235   0.067
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a1aaa2a(a1)aaa1a2aaa2aaaaa12
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A1A[A@@H]2AA[A@H](A1)[AH2+]2
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A1[AH2+]Aa2a(A1)aaa1A=AAAa21
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A1=AA=A2[A@@H](A1)Aa1aaaaa21
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a1aaa2aa3[aH]a4aaaaa4a3aa2a1
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A1AA[A@@H]2AA[AH2+]A[A@H]2A1
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A1AAa2[aH]a3[AH+]AA[a+]3a2A1
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A1A[A@H]2AAa3aaaaa3[A@@H]2A1
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A1AA[A@H]2AAa3aaaaa3[A@H]2A1
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A1AAa2aa3a(aa2A1)aa1AAA=Aa31
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a1aaa2[aH+]a3[aH]aa[a+]3a2a1
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A1AA[A@H]2Aa3aaaa3A[A@@H]2A1
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A1=Aa2aa3a(aa2AA1)aa1AAAAa31
   4.364   1.086   0.032
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A1AAa2a[a+]a3aa4aaaaa4a3a2A1
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A1AAA2=A(A1)Aa1aa3aaaaa3a1A2
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A1A[A@@H]2[AH2+]A[A@H](A1)A2
   1.626   0.084   0.601
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a1aaa2a(a1)Aa1aaaa3AAA=A2a13
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a1aaa2A=A[A@@H]3AAA[A+]3a2a1
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a1aaa2a(a1)AAa1aa3aaaaa3aa21
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A1A[A@H]2[AH2+]A[A@@H](A1)A2
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A1A[A@H]2AA[A@@H](A1)[AH2+]2
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A1AA[A@@H]2AAA[AH2+][A@H]2A1
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A1AA[A@H]2AA[AH2+]A[A@@H]2A1
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A1AA[A+]2[A@H](A1)Aa1aaaaa21
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A1A[A@@H]2Aa3aaaaa3[A@@H]2A1
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A1AA[A@H]2Aa3aaaa3A[A@H]2A1
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A1AA[a+]2a(A1)[aH]a1aaaaa21
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A1A[A@@H]2[AH2+]AA[A@@H]2A1
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A1AAA2(AA1)A[AH+]a1aaaaa1A2
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[AH2+]1AA[AH+]2AAA[A@@H]2A1
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a1aaa2[aH+]a3=AA=A[a+]3a2a1
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a1aaa2a(a1)Aa1aaaa3aaaa2a13
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A1=AA=A2[A@H](A1)Aa1aaaaa21
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A1A[AH+]2AA3A[AH+]1AA(A3)A2
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A1AA[A@H]2AAA[AH2+][A@H]2A1
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A1=AA=A2A(=AA1)AAAa1aaaaa21
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[AH2+]1AAa2a(A1)aa1A=AAAa21
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a1aaa2AA[A@H]3AAA[A+]3a2a1
  -2.615   1.450   0.038
  -3.224   0.216   0.164
  -2.465  -0.939   0.132
  -1.091  -0.867  -0.032
  -0.331  -2.050  -0.037
   1.127  -1.965  -0.267
   1.571  -0.656   0.380
   3.059  -0.341   0.195
   3.101   1.201   0.029
   1.614   1.648   0.060
   0.974   0.381  -0.366
  -0.474   0.384  -0.169
  -1.246   1.535  -0.128
a1aaa2A[A@@H]3AAA[A+]3a2a1
   2.597  -0.924   0.006
   2.931   0.336   0.470
   1.965   1.326   0.468
   0.700   1.057  -0.021
  -0.778   2.037  -0.172
  -1.942   0.655  -0.507
  -2.606   0.208   0.799
  -2.078  -1.216   1.065
  -1.472  -1.657  -0.282
  -0.984  -0.405  -0.911
   0.333  -0.217  -0.466
   1.330  -1.200  -0.453
A1AAA2=Aa3aaaaa3AA[A@H]2A1
   3.459  -0.712   0.493
   3.693   0.699  -0.037
   2.504   1.184  -0.846
   1.193   0.712  -0.341
   0.058   1.373  -0.658
  -1.222   0.752  -0.198
  -2.191   1.475   0.479
  -3.395   0.851   0.763
  -3.596  -0.464   0.380
  -2.611  -1.179  -0.275
  -1.391  -0.563  -0.551
  -0.384  -1.268  -1.086
   0.654  -1.739  -0.182
   0.982  -0.418   0.639
   2.252  -0.710   1.427
a1aaa2Aa3aaaa4aaa(a2a1)a34
  -3.661   0.790   0.004
  -3.865  -0.580  -0.001
  -2.785  -1.445  -0.004
  -1.480  -0.931  -0.001
  -0.328  -1.862  -0.001
   1.006  -1.244  -0.000
   2.212  -1.953  -0.000
   3.414  -1.236   0.005
   3.450   0.132   0.001
   2.256   0.863  -0.001
   1.842   2.260  -0.003
   0.528   2.292  -0.003
   0.008   0.991  -0.001
  -1.277   0.459   0.001
  -2.379   1.311   0.005
   1.060   0.146  -0.001
A1AAa2aaa3aa4AA=AAa4a3a2A1
   2.795  -1.982  -0.412
   3.715  -1.186   0.344
   3.705   0.191  -0.029
   2.295   0.725  -0.014
   2.102   2.117  -0.015
   0.874   2.626  -0.010
  -0.184   1.848  -0.004
  -1.932   2.159   0.001
  -2.512   0.484   0.012
  -3.784  -0.112   0.019
  -3.872  -1.458   0.033
  -2.792  -2.190   0.029
  -1.556  -1.670   0.022
  -1.361  -0.288   0.012
  -0.088   0.440   0.002
   1.222  -0.107  -0.003
   1.373  -1.604   0.007
A1AA=A2[A@H](A1)Aa1aaaaa21
  -3.536   0.383   0.071
  -2.812   1.510   0.025
  -1.422   1.537   0.099
  -0.687   0.507  -0.146
  -1.210  -0.843  -0.624
  -2.749  -1.184   0.277
  -0.116  -1.831  -0.172
   1.117  -0.992   0.006
   2.431  -1.392   0.152
   3.400  -0.388   0.215
   3.063   0.955   0.134
   1.750   1.370   0.003
   0.767   0.370  -0.046
A1AAA2Aa3aaaaa3AA[A@@H]2A1
  -3.688   0.084  -0.961
  -3.737  -0.654   0.387
  -2.449  -1.462   0.505
  -1.267  -0.645   0.226
  -0.080  -1.195   0.553
   1.238  -0.655   0.233
   2.221  -1.562  -0.205
   3.474  -1.120  -0.555
   3.785   0.228  -0.479
   2.839   1.129  -0.042
   1.565   0.696   0.325
   0.664   1.647   0.778
  -0.630   1.669   0.486
  -1.286   0.655  -0.417
  -2.643   1.186  -0.833
A1[AH2+]Aa2aaaa3AAA(A1)a23
   2.435  -0.289  -0.849
   2.578   1.078  -0.260
   1.539   1.380   0.762
   0.133   1.146   0.272
  -0.790   2.138   0.065
  -2.105   1.796  -0.227
  -2.505   0.473  -0.286
  -1.577  -0.537  -0.082
  -1.605  -1.927  -0.026
  -0.347  -2.375   0.200
   0.508  -1.341   0.176
   1.981  -1.358   0.157
  -0.248  -0.183   0.103
A1AA[A@]2(AA1)AAa1aaaaa1A2
  -3.317   0.955  -0.738
  -3.166   0.944   0.718
  -2.486  -0.362   1.144
  -1.167  -0.497   0.380
  -1.425  -0.407  -1.056
  -2.459   0.302  -1.535
  -0.522  -1.849   0.704
   0.731  -2.003  -0.161
   1.559  -0.744  -0.086
   2.883  -0.795  -0.490
   3.671   0.338  -0.447
   3.136   1.536   0.004
   1.813   1.590   0.411
   1.022   0.448   0.367
  -0.271   0.540   0.778
a1aaa2a(a1)a1aaaa3aaaa2a13
   3.697  -0.769  -0.000
   3.735   0.704  -0.000
   2.611   1.387  -0.000
   1.316   0.689  -0.000
   1.277  -0.639  -0.000
   2.542  -1.397  -0.000
  -0.122  -1.094  -0.000
  -0.820  -2.394  -0.000
  -2.141  -2.416  -0.001
  -2.953  -1.179  -0.002
  -2.332  -0.024   0.006
  -2.966   1.305  -0.001
  -2.186   2.371  -0.001
  -0.715   2.319  -0.000
  -0.070   1.180  -0.000
  -0.874  -0.042  -0.000
a1aaa2a(a1)aa1aaa3AAAa3a21
  -3.827   1.065  -0.007
  -2.823   1.922   0.030
  -1.566   1.557   0.042
  -1.211   0.253   0.016
  -2.263  -0.670  -0.022
  -3.585  -0.245  -0.034
  -1.470  -2.254  -0.047
   0.225  -1.723  -0.009
   1.372  -2.368  -0.006
   2.523  -1.725   0.026
   2.555  -0.338   0.063
   3.728   0.619   0.096
   3.147   1.989  -0.319
   1.665   1.857   0.094
   1.378   0.375   0.056
   0.148  -0.319   0.023
A1=A[A@H]2A(A1)AAa1aaaaa21
   2.902  -1.124  -0.414
   1.721  -1.647  -0.009
   0.972  -0.472   0.559
   1.618   0.641  -0.204
   2.916   0.267  -0.151
   1.141   1.899   0.328
  -0.253   1.997  -0.013
  -1.022   0.874  -0.003
  -2.388   0.988  -0.260
  -3.189  -0.139  -0.279
  -2.643  -1.386  -0.034
  -1.290  -1.506   0.226
  -0.486  -0.386   0.249
A1AAA2=A(A1)AA1=A(AAAA1)A2
   3.637   0.756  -0.252
   3.722  -0.636   0.384
   2.452  -1.386   0.087
   1.236  -0.706  -0.116
   1.164   0.636  -0.045
   2.387   1.459   0.280
  -0.000   1.275  -0.257
  -1.164   0.636  -0.045
  -1.236  -0.706  -0.115
  -2.451  -1.386   0.091
  -3.722  -0.635   0.385
  -3.637   0.754  -0.255
  -2.388   1.460   0.277
  -0.000  -1.515  -0.418
a1aaa2aa3aaa4aaaaa4a3aa2a1
  -4.214   1.423  -0.000
  -4.635   0.077   0.000
  -3.717  -0.958  -0.005
  -2.342  -0.664   0.001
  -1.432  -1.639   0.001
  -0.143  -1.333   0.001
   0.875  -2.393   0.001
   2.220  -2.067   0.000
   2.662  -0.672  -0.000
   4.029  -0.367  -0.001
   4.439   0.946  -0.001
   3.511   1.977  -0.001
   2.161   1.702   0.001
   1.721   0.378   0.000
   0.282   0.068   0.001
  -0.616   1.039   0.001
  -1.916   0.738   0.001
  -2.891   1.752   0.000
A1A=Aa2a(A1)[aH+]a1aaaaa21
   3.404  -0.210  -0.034
   2.996   1.125   0.024
   1.732   1.448   0.037
   0.742   0.444  -0.007
   1.120  -0.897  -0.065
   2.500  -1.210  -0.078
  -0.018  -1.638   0.252
  -1.141  -0.878  -0.071
  -2.503  -1.169  -0.079
  -3.425  -0.145  -0.034
  -3.008   1.179   0.024
  -1.677   1.485   0.037
  -0.728   0.464  -0.007
A1[AH2+]Aa2a(A1)aa1aaaaa21
   3.398   0.149   0.410
   3.036  -1.048  -0.380
   1.717  -1.568   0.055
   0.735  -0.428   0.027
   1.083   0.871  -0.030
   2.525   1.327  -0.042
  -0.018   1.634  -0.060
  -1.133   0.873  -0.033
  -2.495   1.172  -0.045
  -3.427   0.149  -0.012
  -3.018  -1.175   0.037
  -1.678  -1.490   0.054
  -0.724  -0.471   0.022
a1aaa2[aH]a3=AA=A[a+]3a2a1
  -2.758   1.093  -0.029
  -3.121  -0.243  -0.008
  -2.152  -1.226   0.002
  -0.809  -0.875  -0.009
   0.364  -1.622  -0.004
   1.432  -0.746  -0.028
   2.747  -0.693  -0.043
   3.141   0.597  -0.066
   2.030   1.376  -0.066
   1.000   0.416   0.304
  -0.444   0.472  -0.026
  -1.425   1.453  -0.031
[AH2+]1AAa2a(A1)aa1aaaaa21
  -3.500  -0.067  -0.365
  -2.988  -1.205   0.421
  -1.572  -1.566  -0.036
  -0.725  -0.296  -0.011
  -1.325   0.913   0.017
  -2.800   1.177   0.025
   0.001   2.086   0.042
   1.363   0.949   0.013
   2.734   1.091   0.013
   3.534  -0.034  -0.015
   2.945  -1.291  -0.044
   1.594  -1.444  -0.039
   0.740  -0.315  -0.016
a1aaa2a(a1)Aa1aaaa3aaa2a13
  -3.882  -0.537  -0.002
  -3.697   0.839  -0.004
  -2.428   1.371  -0.002
  -1.315   0.525   0.001
  -1.501  -0.879   0.002
  -2.804  -1.390   0.001
  -0.361  -1.823   0.003
   0.946  -1.285   0.001
   2.148  -2.009  -0.001
   3.373  -1.329  -0.003
   3.513   0.044  -0.003
   2.310   0.887   0.000
   1.914   2.128   0.001
   0.689   2.244   0.002
   0.040   1.073   0.001
   1.053   0.148   0.001
A1A[A@H]2A[AH2+]A[A@@H]2A1
  -2.261  -0.007   0.089
  -1.321  -1.232  -0.163
   0.003  -0.711   0.367
   1.344  -1.204  -0.139
   2.208  -0.002   0.085
   1.356   1.210   0.038
   0.001   0.699  -0.348
  -1.330   1.247   0.073
[AH2+]1AAa2aa3AAA=Aa3aa2A1
   3.594   0.571   0.385
   3.545  -0.700  -0.364
   2.360  -1.397   0.027
   1.195  -0.697   0.010
  -0.006  -1.392   0.039
  -1.207  -0.701   0.025
  -2.385  -1.360   0.053
  -3.555  -0.703   0.039
  -3.615   0.705  -0.005
  -2.465   1.429  -0.039
  -1.192   0.706  -0.019
   0.027   1.391  -0.048
   1.203   0.695  -0.035
   2.505   1.456  -0.070
A1AA=A2Aa3aaaaa3AA[A@H]2A1
   3.897  -0.193   0.291
   3.072  -1.354   0.861
   1.804  -1.487   0.072
   1.173  -0.479  -0.485
  -0.024  -0.756  -1.156
  -1.237  -0.514  -0.503
  -2.131  -1.532  -0.228
  -3.335  -1.242   0.389
  -3.645   0.061   0.733
  -2.754   1.085   0.467
  -1.546   0.807  -0.146
  -0.615   1.818  -0.415
   0.669   1.820   0.294
   1.670   0.934  -0.436
   3.001   1.025   0.261
A1AA[A@@]2(A1)AAAa1aaaaa21
  -2.828  -1.042  -0.425
  -2.798  -0.694   0.867
  -1.755   0.118   1.138
  -1.032   0.299  -0.176
  -1.812  -0.504  -1.126
  -1.032   1.768  -0.586
   0.004   2.509   0.270
   1.297   1.981  -0.028
   1.456   0.632  -0.007
   2.743   0.114   0.086
   2.944  -1.251   0.102
   1.860  -2.110   0.025
   0.578  -1.597  -0.065
   0.372  -0.228  -0.080
[AH2+]1AAA2(AAA[AH2+]2)AA1
   2.564   0.170   0.043
   1.923  -1.050  -0.491
   0.676  -1.360   0.342
  -0.290  -0.180   0.262
  -0.781  -0.016  -1.108
  -2.109   0.219  -1.086
  -2.573   0.215   0.355
  -1.473  -0.422   1.066
   0.405   1.097   0.732
   1.660   1.330  -0.114
a1aaa2A3AAA(a2a1)a1aaaaa31
  -3.275  -1.098  -0.657
  -3.275  -1.053   0.725
  -2.231  -0.444   1.410
  -1.207   0.106   0.693
  -0.000   0.805   1.300
  -0.000   2.224   0.693
  -0.001   2.174  -0.833
  -0.000   0.720  -1.349
  -1.207   0.061  -0.699
  -2.230  -0.535  -1.379
   1.207   0.062  -0.699
   2.231  -0.534  -1.379
   3.275  -1.097  -0.656
   3.275  -1.053   0.725
   2.231  -0.445   1.410
   1.207   0.107   0.694
[AH2+]1AAa2a(A1)aa1AAAAa21
  -3.469  -0.067  -0.440
  -3.007  -1.193   0.398
  -1.581  -1.575  -0.007
  -0.723  -0.315   0.023
  -1.312   0.904   0.014
  -2.782   1.181  -0.028
   0.030   2.059   0.059
   1.336   0.952   0.090
   2.695   1.126   0.135
   3.522   0.014  -0.371
   2.944  -1.278  -0.016
   1.616  -1.498   0.082
   0.728  -0.313   0.061
A1A[A@H]2Aa3aaaaa3[A@H]2A1
   3.100  -0.710  -0.542
   2.917   0.707   0.038
   1.555   0.721   0.756
   0.576   1.591  -0.059
  -0.731   0.828  -0.071
  -2.013   1.253  -0.379
  -3.074   0.370  -0.324
  -2.858  -0.945   0.039
  -1.577  -1.375   0.348
  -0.510  -0.485   0.294
   0.958  -0.701   0.583
   1.657  -1.255  -0.684
A1A[A@@H]2A[AH2+]A[A@H]2A1
  -2.260   0.004   0.085
  -1.330  -1.248   0.060
   0.004  -0.699  -0.347
   1.357  -1.209   0.052
   2.207   0.005   0.088
   1.341   1.201  -0.159
   0.005   0.711   0.366
  -1.324   1.234  -0.142
A1AAa2aa3a(AAa4aaaa34)a2A1
   3.969   0.992   0.429
   4.361  -0.246  -0.383
   3.445  -1.411   0.018
   2.029  -0.922   0.011
   0.542  -1.882   0.032
  -0.610  -0.598   0.008
   0.160   0.559  -0.016
  -0.582   1.841  -0.046
  -1.925   1.832  -0.038
  -2.640   0.646  -0.013
  -3.930   0.407  -0.006
  -4.115  -0.981   0.022
  -2.934  -1.548   0.031
  -1.986  -0.559   0.010
   1.611   0.359  -0.014
   2.608   1.512  -0.038
A1AAa2a(A1)[aH]a1AAA[a+]21
  -3.091  -0.248  -0.000
  -2.776   1.058  -0.000
  -1.486   1.459  -0.000
  -0.439   0.439   0.000
  -0.816  -0.895   0.001
  -2.155  -1.214   0.000
   0.336  -1.619   0.001
   1.393  -0.732  -0.005
   2.782  -0.782   0.001
   3.302   0.592   0.001
   2.030   1.458   0.000
   0.924   0.483   0.001
A1AAa2a(A1)aa1[AH+]AAAa21
  -3.321  -0.200   0.033
  -2.954   1.090   0.012
  -1.655   1.478  -0.018
  -0.692   0.451  -0.028
  -1.088  -0.896  -0.007
  -2.436  -1.223   0.024
   0.007  -1.639  -0.024
   1.068  -0.864  -0.056
   2.421  -1.143   0.256
   3.371  -0.177  -0.416
   2.995   1.092   0.362
   1.612   1.577  -0.086
   0.678   0.449  -0.057
A1AAA2=A(A1)AA1=A(AAA1)A2
   3.337  -0.743   0.351
   3.443   0.625  -0.331
   2.153   1.370  -0.130
   0.931   0.690   0.041
   0.876  -0.657   0.002
   2.126  -1.475  -0.230
  -0.302  -1.350   0.162
  -1.489  -0.667   0.057
  -1.532   0.704   0.100
  -2.863   1.099  -0.037
  -3.617  -0.016  -0.156
  -2.760  -1.128  -0.096
  -0.298   1.544   0.268
A1AAA2=A(A1)Aa1[aH]aaa1A2
   3.153   0.782   0.710
   3.459  -0.586   0.090
   2.174  -1.356  -0.039
   0.934  -0.701  -0.183
   0.856   0.640  -0.236
   2.112   1.482  -0.163
  -0.312   1.311  -0.362
  -1.457   0.648  -0.117
  -2.709   1.131   0.113
  -3.566   0.037   0.313
  -2.832  -1.092   0.205
  -1.514  -0.718  -0.063
  -0.298  -1.579  -0.273
A1AAA2[A@H](A1)Aa1aaaaa21
  -3.290   0.079  -0.373
  -2.960  -1.265   0.204
  -1.457  -1.528   0.294
  -0.718  -0.385  -0.203
  -1.200   0.858   0.466
  -2.477   1.154  -0.196
  -0.084   1.840   0.062
   1.128   0.921   0.007
   2.478   1.181   0.050
   3.389   0.141   0.007
   2.940  -1.165  -0.080
   1.588  -1.433  -0.136
   0.662  -0.393  -0.104
A1AAa2aa3a4aaaaa4aaa3a2A1
  -4.322   0.597   0.397
  -4.389  -0.703  -0.410
  -3.263  -1.642   0.037
  -1.962  -0.873   0.024
  -0.722  -1.385   0.036
   0.204  -0.404   0.012
   1.615  -0.408   0.010
   2.336  -1.611   0.036
   3.699  -1.582   0.032
   4.387  -0.373   0.002
   3.718   0.814  -0.023
   2.315   0.822  -0.019
   1.596   2.041  -0.044
   0.235   2.032  -0.042
  -0.475   0.818  -0.014
  -1.893   0.470  -0.006
  -3.081   1.394  -0.025
A1AA[A@]2(A1)AAAa1aaaaa21
  -2.829   1.047  -0.414
  -2.792   0.693   0.877
  -1.748  -0.119   1.140
  -1.032  -0.295  -0.180
  -1.820   0.507  -1.124
  -1.034  -1.764  -0.593
  -0.003  -2.508   0.267
   1.292  -1.983  -0.023
   1.455  -0.634  -0.006
   2.742  -0.118   0.094
   2.946   1.246   0.108
   1.865   2.107   0.022
   0.583   1.598  -0.075
   0.374   0.229  -0.087
A1AAa2a(A1)[aH+]a1aaaaa21
  -3.429   0.156   0.374
  -3.061  -1.133  -0.366
  -1.672  -1.599   0.087
  -0.726  -0.429   0.003
  -1.107   0.859  -0.096
  -2.550   1.305  -0.133
   0.005   1.634   0.198
   1.141   0.890  -0.094
   2.499   1.194  -0.117
   3.433   0.185  -0.036
   3.037  -1.140   0.074
   1.695  -1.467   0.091
   0.733  -0.452   0.009
a1aaa2a(a1)a[a+]a1aaaaa21
  -3.506  -0.252  -0.000
  -2.864  -1.485  -0.000
  -1.499  -1.564  -0.000
  -0.745  -0.394  -0.000
  -1.393   0.865   0.001
  -2.792   0.912   0.001
  -0.606   2.038  -0.000
   0.696   1.991  -0.001
   1.395   0.845  -0.001
   2.800   0.865  -0.001
   3.502  -0.298   0.004
   2.841  -1.539  -0.001
   1.448  -1.588  -0.001
   0.722  -0.401  -0.000
a1aaa2[AH+]a3aaaaa3AAa2a1
   3.472   0.026   0.918
   3.151   1.302   0.490
   2.001   1.522  -0.244
   1.159   0.469  -0.557
   0.008   0.720  -1.293
  -1.143   0.475  -0.554
  -1.957   1.549  -0.227
  -3.108   1.356   0.511
  -3.456   0.084   0.928
  -2.652  -0.989   0.605
  -1.491  -0.799  -0.142
  -0.718  -1.910  -0.458
   0.607  -1.957  -0.455
   1.478  -0.816  -0.132
   2.643  -1.032   0.611
a1aaa2A=a3[aH]aa[a+]3a2a1
  -2.759  -1.085   0.020
  -3.109   0.258   0.004
  -2.147   1.228  -0.003
  -0.795   0.870   0.011
   0.358   1.583   0.008
   1.387   0.761   0.028
   2.761   0.720   0.038
   3.145  -0.610   0.061
   2.051  -1.363   0.064
   0.986  -0.412  -0.302
  -0.441  -0.490   0.034
  -1.432  -1.461   0.041
A1A[A@H]2AA=A[A@@H](A1)A2
  -1.382   0.231   0.899
  -1.005   1.422   0.211
   0.269   1.209  -0.596
   1.478   1.014   0.312
   1.533  -0.381   0.855
   0.807  -1.373   0.431
  -0.241  -1.215  -0.641
  -1.583  -0.901   0.046
   0.124  -0.007  -1.516
A1AAA2Aa3aaaaa3AA[A@H]2A1
   3.692   0.089  -0.957
   3.737  -0.663   0.383
   2.448  -1.469   0.491
   1.268  -0.645   0.224
   0.081  -1.193   0.555
  -1.237  -0.654   0.234
  -2.223  -1.563  -0.195
  -3.473  -1.121  -0.553
  -3.785   0.227  -0.482
  -2.839   1.129  -0.046
  -1.563   0.698   0.318
  -0.666   1.649   0.775
   0.629   1.671   0.489
   1.290   0.658  -0.411
   2.648   1.191  -0.820
a1aaa2a(a1)aaa1aaa[a+]a21
   3.482   0.335   0.000
   2.798   1.545  -0.000
   1.433   1.577  -0.000
   0.714   0.379  -0.000
   1.405  -0.854   0.000
   2.808  -0.851   0.000
   0.682  -2.068   0.001
  -0.668  -2.078   0.001
  -1.412  -0.879  -0.005
  -2.825  -0.902   0.001
  -3.502   0.329   0.001
  -2.760   1.518   0.001
  -1.408   1.576   0.000
  -0.752   0.367  -0.000
a1aaa2A[A@H]3AAA[A+]3a2a1
   2.795   0.948  -0.041
   3.019  -0.372   0.306
   1.963  -1.264   0.359
   0.677  -0.839   0.059
  -0.544  -1.534   0.049
  -1.473  -0.685  -0.731
  -2.857  -0.706  -0.059
  -3.043   0.710   0.532
  -1.588   1.223   0.668
  -0.920   0.643  -0.515
   0.451   0.493  -0.287
   1.516   1.382  -0.337
A1AA[A@@]2(AAAa3aaaa23)A1
   2.799  -0.683  -0.657
   2.716  -0.643   0.680
   1.590  -0.086   1.149
   0.732   0.337  -0.015
   0.625   1.839  -0.000
  -0.599   2.406   0.019
  -1.720   1.670   0.034
  -1.699   0.209   0.019
  -2.697  -0.741   0.026
  -2.072  -1.992   0.010
  -0.733  -1.787  -0.006
  -0.492  -0.463  -0.002
   1.550  -0.066  -1.251
A1AAa2a(=A1)[aH]a1aaaaa21
  -3.456  -0.163  -0.001
  -2.940   1.216  -0.000
  -1.610   1.408   0.000
  -0.724   0.396   0.001
  -1.103  -0.924   0.000
  -2.428  -1.275  -0.000
   0.022  -1.711   0.000
   1.137  -0.879   0.000
   2.503  -1.133   0.000
   3.397  -0.081  -0.001
   2.939   1.225  -0.000
   1.583   1.487   0.000
   0.678   0.436   0.001
a1aaa2aa3a4aaaaa4aaa3a2a1
   4.245   0.742  -0.001
   4.417  -0.636  -0.001
   3.336  -1.470  -0.000
   2.045  -0.932   0.001
   0.705  -1.522   0.001
  -0.182  -0.491  -0.000
  -1.652  -0.438   0.001
  -2.430  -1.591   0.001
  -3.806  -1.484   0.001
  -4.415  -0.238  -0.005
  -3.659   0.916   0.001
  -2.268   0.833   0.001
  -1.489   1.948   0.001
  -0.196   1.894  -0.000
   0.508   0.717   0.001
   1.866   0.464  -0.000
   2.983   1.294  -0.001
[AH2+]1AA2A[AH2+]AA(A1)A2
  -1.204  -0.060  -1.054
  -1.187  -1.276  -0.207
   0.063  -1.246   0.678
   1.306  -1.152  -0.211
   1.201   0.059  -1.054
   1.186   1.271  -0.206
  -0.060   1.238   0.683
  -1.308   1.171  -0.204
   0.003  -0.006   1.579
A1AAa2[aH]a3AAAAa3[a+]2A1
  -2.967  -1.169   0.402
  -3.410   0.108  -0.323
  -2.455   1.181   0.012
  -1.106   0.837   0.009
  -0.037   1.681   0.048
   1.091   0.913   0.026
   2.439   1.191   0.045
   3.347   0.199   0.019
   2.992  -1.096  -0.037
   1.691  -1.458  -0.059
   0.672  -0.409  -0.026
  -0.685  -0.408  -0.035
  -1.573  -1.576  -0.087
A1=[A+]Aa2a(A1)aa1aaaaa21
   3.326   0.203  -0.132
   3.069  -1.112  -0.139
   1.643  -1.543   0.132
   0.688  -0.437   0.074
   1.074   0.883   0.057
   2.420   1.225   0.083
   0.026   1.649   0.012
  -1.099   0.881  -0.007
  -2.461   1.183  -0.055
  -3.389   0.165  -0.062
  -2.979  -1.160  -0.023
  -1.637  -1.475   0.023
  -0.687  -0.464   0.032
A1AA[a+]2a(=A1)aa1aaaaa21
   3.475   0.009   0.000
   2.872  -1.335  -0.179
   1.460  -1.491   0.270
   0.713  -0.335  -0.224
   1.352   0.884   0.050
   2.648   1.074   0.034
   0.043   2.084   0.020
  -1.315   0.954   0.007
  -2.674   1.153  -0.038
  -3.466   0.009  -0.042
  -2.891  -1.246  -0.002
  -1.525  -1.448   0.047
  -0.693  -0.312   0.056
A1A[A@@H]2AAa3aaaaa3A2=A1
  -3.098   0.854   0.381
  -3.106  -0.284  -0.502
  -1.624  -0.616  -0.677
  -1.169  -1.858   0.071
   0.221  -1.843   0.352
   1.059  -0.807   0.162
   2.431  -0.989   0.114
   3.275   0.100  -0.038
   2.766   1.392  -0.157
   1.395   1.594  -0.129
   0.556   0.508   0.017
  -0.915   0.567  -0.000
  -1.785   1.386   0.411
A1[AH2+]Aa2aa3AAA=Aa3a2A1
  -3.002   1.191  -0.404
  -3.463   0.074   0.446
  -2.780  -1.179   0.044
  -1.310  -0.905  -0.006
   0.031  -2.063  -0.052
   1.336  -0.957  -0.100
   2.699  -1.121  -0.154
   3.513  -0.006   0.363
   2.908   1.287   0.066
   1.630   1.490  -0.094
   0.732   0.307  -0.074
  -0.718   0.313  -0.028
  -1.573   1.575  -0.008
A1AA=A2Aa3aaaaa3A[A@H]2A1
   3.633   0.753  -0.397
   3.735  -0.693   0.064
   2.402  -1.354   0.180
   1.229  -0.745  -0.002
   0.016  -1.487   0.106
  -1.252  -0.727   0.049
  -2.476  -1.378  -0.076
  -3.639  -0.638  -0.140
  -3.589   0.745  -0.084
  -2.380   1.401   0.045
  -1.203   0.673   0.119
  -0.012   1.301   0.271
   1.143   0.724  -0.336
   2.397   1.424   0.197
A1AA[A+]2A(=Aa3aaaaa23)A1
   3.399   0.146   0.019
   2.934  -1.180  -0.369
   1.610  -1.555   0.296
   0.672  -0.402  -0.195
   1.112   0.885   0.086
   0.049   1.705  -0.001
  -1.117   0.896  -0.007
  -2.484   1.190  -0.086
  -3.399   0.179  -0.076
  -2.986  -1.147   0.012
  -1.647  -1.462   0.095
  -0.693  -0.447   0.088
   2.553   1.195   0.141
A1AA[A@]2(AAAa3aaaaa23)A1
   2.832  -1.095   0.659
   2.759  -1.041  -0.678
   1.762  -0.276  -1.148
   1.005   0.308   0.014
   1.187   1.802  -0.006
   0.098   2.597  -0.018
  -1.153   2.117  -0.023
  -1.450   0.673  -0.015
  -2.764   0.207  -0.025
  -3.007  -1.152  -0.018
  -1.957  -2.053  -0.002
  -0.646  -1.597   0.008
  -0.393  -0.246   0.002
   1.727  -0.245   1.252
A1=AA[A@]2(A1)AAa1aaaaa21
  -2.733   0.986  -0.671
  -2.675   0.925   0.624
  -1.824  -0.110   1.086
  -0.999  -0.503  -0.011
  -1.826  -0.094  -1.238
  -0.703  -1.975  -0.005
   0.639  -2.097   0.022
   1.281  -0.856   0.030
   2.635  -0.531   0.055
   3.032   0.790   0.055
   2.090   1.802   0.031
   0.743   1.489   0.010
   0.341   0.172   0.009
A1[AH2+]Aa2aa3aaaaa3aa2A1
   3.594  -0.669  -0.402
   3.591   0.577   0.391
   2.497   1.450  -0.065
   1.191   0.699  -0.030
   0.013   1.431  -0.052
  -1.212   0.730  -0.016
  -2.442   1.401  -0.038
  -3.600   0.684  -0.010
  -3.578  -0.708   0.035
  -2.399  -1.390   0.053
  -1.184  -0.685   0.025
  -0.014  -1.325   0.042
   1.140  -0.686   0.019
   2.403  -1.514   0.050
A1AA[A@@H]2A[AH2+]AA=A2A1
   2.423  -0.673   0.326
   2.424   0.810  -0.049
   1.101   1.453   0.372
  -0.049   0.799  -0.398
  -1.377   1.389   0.044
  -2.478   0.473  -0.307
  -2.357  -0.770   0.478
  -1.020  -1.393   0.188
   0.006  -0.690  -0.196
   1.324  -1.397  -0.457
A1A[A@H]2[AH2+]AA[A@H]2A1
  -2.106   0.287   0.209
  -0.936   1.277   0.429
   0.110   0.767  -0.595
   1.454   1.010  -0.043
   2.109  -0.288   0.202
   0.937  -1.273   0.431
  -0.111  -0.768  -0.585
  -1.457  -1.011  -0.050
A1Aa2aaa3AAa4aaa(A1)a2a34
   3.289  -0.000  -0.001
   2.650   1.188   0.004
   1.182   1.233   0.001
   0.432   2.399  -0.001
  -0.964   2.363  -0.001
  -1.644   1.178  -0.001
  -3.097   0.773  -0.000
  -3.097  -0.773   0.001
  -1.644  -1.178   0.001
  -0.964  -2.363  -0.000
   0.432  -2.399  -0.000
   1.182  -1.233  -0.000
   2.650  -1.188  -0.001
   0.492  -0.000  -0.000
  -0.901  -0.000  -0.000
A1AA2Aa3aaaaa3AA[A@@H]2A1
   3.594  -0.571   0.497
   2.797  -0.770  -0.822
   1.414  -0.606  -0.402
   0.288  -1.269  -0.787
  -1.001  -0.723  -0.247
  -1.979  -1.529   0.309
  -3.194  -0.947   0.635
  -3.397   0.404   0.403
  -2.401   1.203  -0.124
  -1.165   0.632  -0.434
  -0.124   1.391  -0.896
   0.995   1.792   0.004
   1.353   0.397   0.701
   2.820   0.594   1.162
a1aaa2a(a1)[aH+]a1aaaaa21
  -3.432   0.173  -0.001
  -3.035  -1.152   0.004
  -1.691  -1.471  -0.002
  -0.741  -0.456  -0.001
  -1.143   0.879  -0.000
  -2.489   1.185  -0.001
   0.000   1.681   0.000
   1.143   0.879   0.000
   2.489   1.185   0.001
   3.431   0.173   0.000
   3.035  -1.152   0.000
   1.691  -1.471  -0.000
   0.741  -0.456  -0.000
A1AA[A@@]2(A1)AAa1aaaaa21
  -2.977   0.772   0.652
  -2.891   0.727  -0.685
  -1.797   0.105  -1.150
  -0.976  -0.367   0.018
  -1.768   0.081   1.251
  -0.777  -1.857  -0.006
   0.554  -2.069  -0.022
   1.277  -0.871  -0.018
   2.654  -0.636  -0.036
   3.137   0.661  -0.027
   2.261   1.731  -0.002
   0.896   1.504   0.016
   0.409   0.215   0.007
A1A[A@H]2A[AH2+]A[A@H]2A1
   1.673   0.313  -0.693
   0.665   1.276  -0.362
  -0.088   0.760   0.747
  -1.592   0.785   0.392
  -1.767  -0.291  -0.599
  -0.699  -1.284  -0.419
   0.222  -0.773   0.707
   1.583  -0.786   0.227
a1aaa2[aH+]a3[a+]aaa3a2a1
  -2.758   1.081  -0.034
  -3.120  -0.255   0.034
  -2.151  -1.235   0.092
  -0.808  -0.883   0.072
   0.365  -1.582  -0.242
   1.428  -0.753   0.071
   2.753  -0.718   0.073
   3.172   0.550   0.010
   2.042   1.371  -0.035
   0.947   0.515   0.005
  -0.444   0.463   0.004
  -1.427   1.442  -0.049
A1AAa2aaa3aa4aaaaa4a3a2A1
   2.933   2.044   0.408
   3.807   1.201  -0.350
   3.728  -0.174   0.024
   2.295  -0.634   0.014
   2.014  -1.993   0.018
   0.777  -2.440   0.015
  -0.265  -1.619   0.007
  -1.596  -1.844   0.004
  -2.292  -0.689  -0.009
  -3.659  -0.390  -0.018
  -4.036   0.884  -0.036
  -3.148   1.861  -0.033
  -1.852   1.628  -0.025
  -1.389   0.381  -0.013
  -0.052  -0.232  -0.001
   1.250   0.266   0.002
   1.490   1.751  -0.011
A1=Aa2aa3aaaaa3[aH]a2=AA1
   3.567   0.767   0.000
   2.386   1.434   0.000
   1.166   0.713   0.000
   0.012   1.354   0.000
  -1.155   0.689   0.000
  -2.365   1.405  -0.001
  -3.553   0.736  -0.001
  -3.585  -0.653   0.000
  -2.414  -1.380   0.001
  -1.189  -0.721   0.001
  -0.012  -1.446   0.001
   1.186  -0.760   0.001
   2.371  -1.429  -0.005
   3.585  -0.707   0.001
a1aaa2[AH+]AAa3aaaaa3a2a1
  -2.824   1.560  -0.576
  -3.502   0.464  -0.072
  -2.805  -0.616   0.439
  -1.423  -0.601   0.449
  -0.686  -1.694   1.008
   0.091  -2.489   0.009
   0.802  -1.681  -0.922
   1.468  -0.608  -0.435
   2.788  -0.586  -0.368
   3.397   0.497   0.107
   2.701   1.551   0.513
   1.414   1.571   0.467
   0.746   0.524   0.007
  -0.730   0.518  -0.052
  -1.443   1.593  -0.569
a1aaa2a(a1)aaa1[a+]aaaa21
  -3.548   0.182   0.002
  -2.940   1.427  -0.000
  -1.574   1.552  -0.001
  -0.737   0.438  -0.001
  -1.376  -0.832   0.001
  -2.776  -0.937   0.002
  -0.623  -2.028  -0.005
   0.717  -1.994   0.001
   1.419  -0.766   0.001
   2.789  -0.905   0.002
   3.499   0.248   0.001
   2.899   1.502  -0.000
   1.525   1.628  -0.001
   0.731   0.479  -0.000
a1aa[a+]2a(=Aa3aaaaa23)a1
  -3.346   0.138  -0.040
  -2.922  -1.201  -0.053
  -1.599  -1.482  -0.050
  -0.693  -0.386   0.311
  -1.148   0.854  -0.022
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a1aaa2A[AH2+]Aa3aaaa3a2a1
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A1=AAa2a(A1)[aH]a1aaaaa21
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a1aa2AA[AH+]a3aaaa(a1)a23
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a1aaa2a(a1)[aH]a1AAA=Aa21
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A1=AA2AAa3aaaaa3[A@@H]2A1
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A1=AA2=A(AA1)A=a1aaaaa1A2
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A1AA[A@@H]2AA=AA[A@@H]2A1
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A1AA=A2Aa3aaaa3A[A@@H]2A1
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A1A[A@@H]2AA=A[A@H](A1)A2
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A1AAA2=A(A1)Aa1a[aH]aa1A2
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a1aaa2AAa3aa4aaaa4aa3a2a1
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a1aaa2a(a1)[a+]a1aaaaa21
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A1AAA2=A(A1)Aa1aaaaa1AA2
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a1aa2AAA[A+]3AAAa(a1)a23
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a1aaa2AAA3=AA=A[A+]3a2a1
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a1aaa2aaa3=AA=A[a+]3a2a1
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A1Aa2aaa(aa2)AAa2aaa1aa2
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A1[AH2+]Aa2aa3aaaaa3a2A1
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A1[AH2+]Aa2aa3AAAa3aa2A1
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A1=AA[A@@H]2AAA[A@@H]2A1
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A1A[A@@H]2AAa3aaaaa3A2A1
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A1AAa2a(A1)[aH]a1aaaaa21
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A1A[A@H]2A=Aa3aaaaa3A2A1
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A1AAa2aa3aaa4aaaa4a3a2A1
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A1=AA2=A(AA1)Aa1aaaaa1A2
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A1AA[A@@H]2AA=AA[A@H]2A1
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A1AA[A@@H]2AAAA[A@@H]2A1
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A1AA[A@]2(A1)AAa1aaaaa21
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A1AA[A@]2(AAAa3aaaa23)A1
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A1AA=A2Aa3aaaa3A[A@H]2A1
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a1aa2aaaa3[aH]aaa(a1)a23
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A1AA[A@@H]2AAA=A[A@H]2A1
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A1=AAA2=A(A1)a1aaaaa1AA2
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A1AA[A@H]2AAA=A[A@@H]2A1
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A1=A[A@H]2AA[A@@H](A1)A2
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A1A[A@H]2AAa3aaaaa3A2=A1
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A1AAa2a(A1)[a+]a1aaaaa21
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   2.836   1.195   0.043
   0.129   1.668   0.039
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A1AA[A@H]2A[AH2+]AA=A2A1
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   2.250   0.633   0.497
   2.452  -0.745   0.004
   1.111  -1.434   0.055
   0.005  -0.747  -0.163
  -1.316  -1.408  -0.008
A1=AA2AAa3aaaaa3[A@H]2A1
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   0.955  -0.867  -0.038
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   3.147   0.073  -0.373
   2.669   1.324  -0.027
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  -0.951   0.582   0.722
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a1aaa2a(a1)aa1a[aH]aaa21
   3.405  -0.225   0.000
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   1.723   1.480   0.000
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   1.096  -0.878   0.000
   2.466  -1.209   0.000
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  -3.022   1.112   0.000
  -1.723   1.499   0.000
  -0.723   0.517   0.000
A1=AAA2=A(A1)Aa1aaaaa1A2
  -3.503  -0.755   0.218
  -3.656   0.591   0.236
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   2.343  -1.443   0.023
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   2.492   1.340   0.028
   1.252   0.704  -0.014
  -0.007   1.471  -0.057
A1A=AA2=A(A1)a1aaaaa1AA2
  -2.799  -1.511   0.000
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  -2.806   0.949   0.000
  -1.402   0.880   0.000
  -0.757  -0.363   0.001
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   2.770  -1.599   0.001
   3.475  -0.404   0.001
   2.811   0.804   0.000
   1.419   0.831   0.000
   0.750   2.039  -0.001
  -0.593   2.106  -0.001
a1aaa2Aa3[a+]aaaa3AAa2a1
  -3.923  -0.238  -0.060
  -3.669   1.123  -0.099
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  -1.293   0.640   0.064
   0.022   1.315  -0.006
   1.323   0.615  -0.078
   2.361   1.475   0.018
   3.609   1.097   0.114
   3.915  -0.252   0.103
   2.884  -1.149  -0.052
   1.549  -0.691  -0.176
   0.625  -1.865  -0.417
  -0.629  -1.851   0.401
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  -2.873  -1.108   0.069
A1A[A@@H]2Aa3aaaaa3AA2A1
  -3.445  -0.026   0.454
  -2.897  -1.095  -0.188
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  -0.435  -1.419   0.025
   0.866  -0.660   0.022
   2.033  -1.407   0.159
   3.264  -0.789   0.198
   3.347   0.588   0.100
   2.194   1.332  -0.043
   0.954   0.709  -0.090
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  -1.458   0.764  -0.140
  -2.621   1.031   0.456
A1AA=a2[aH]a3aaaaa3aa2A1
  -3.567   0.663  -0.001
  -3.495  -0.675  -0.001
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   1.175  -0.720   0.006
   2.397  -1.387  -0.002
   3.571  -0.668  -0.002
   3.550   0.723  -0.001
   2.369   1.401   0.000
   1.152   0.693   0.000
  -0.009   1.363   0.000
  -1.150   0.722   0.000
  -2.451   1.428   0.000
a1aaa2Aa3aaaaa3[AH+]a2a1
   3.482  -0.925  -0.332
   3.642   0.438  -0.526
   2.590   1.303  -0.290
   1.371   0.801   0.130
   0.000   1.874   0.431
  -1.371   0.801   0.130
  -2.588   1.303  -0.296
  -3.642   0.438  -0.525
  -3.483  -0.925  -0.330
  -2.276  -1.438   0.094
  -1.199  -0.580   0.331
   0.000  -1.076   0.754
   1.198  -0.580   0.331
   2.275  -1.438   0.092
A1=AA=A2A(A1)AAa1aaaaa21
   3.504   0.314   0.052
   2.856   1.521   0.247
   1.447   1.551   0.216
   0.739   0.372  -0.006
   1.399  -0.807  -0.216
   2.742  -0.859  -0.176
   0.627  -2.026  -0.493
  -0.584  -2.070   0.465
  -1.409  -0.831   0.216
  -2.783  -0.867   0.214
  -3.501   0.296  -0.016
  -2.844   1.493  -0.244
  -1.463   1.542  -0.245
  -0.736   0.377  -0.015
a1aaa2a(a1)aaa1[aH]aaa21
   3.206   0.126   0.004
   2.694   1.300  -0.002
   1.391   1.522  -0.001
   0.518   0.422  -0.001
   1.080  -0.880  -0.001
   2.487  -0.982  -0.001
   0.223  -1.990  -0.001
  -1.078  -1.843   0.000
  -1.685  -0.656   0.000
  -3.000  -0.279   0.000
  -3.057   1.120   0.001
  -1.847   1.605   0.000
  -0.934   0.533   0.000
A1=AA2=Aa3aaaaa3[A+]2AA1
  -3.313   0.209  -0.025
  -2.423   1.177   0.111
  -1.109   0.851   0.093
  -0.063   1.633   0.015
   1.070   0.880  -0.001
   2.427   1.202  -0.078
   3.371   0.199  -0.077
   2.983  -1.130   0.001
   1.648  -1.466   0.078
   0.680  -0.472   0.079
  -0.694  -0.417  -0.207
  -1.641  -1.577   0.264
  -2.932  -1.087  -0.253
A1AAA2=A(AA1)a1aaaaa1AA2
   3.500   0.945   0.438
   3.254  -0.554   0.557
   2.461  -1.033  -0.561
   1.118  -0.967  -0.416
   0.526   0.256  -0.347
   1.363   1.457  -0.458
   2.286   1.681   0.510
  -0.938   0.354  -0.162
  -1.624   1.540  -0.389
  -2.995   1.587  -0.191
  -3.682   0.453   0.221
  -3.005  -0.733   0.441
  -1.637  -0.791   0.250
  -0.917  -1.975   0.455
   0.290  -2.220  -0.344
A1A[A@@H]2AAA[A@H](A1)A2
  -1.573   0.083  -0.957
  -1.272   1.347  -0.116
   0.082   1.164   0.567
   1.238   1.235  -0.409
   1.971  -0.115  -0.487
   0.927  -1.205  -0.531
  -0.081  -1.302   0.541
  -1.462  -1.130  -0.090
   0.171  -0.078   1.479
A1AA2Aa3aaaaa3AA[A@H]2A1
   3.628   0.007  -0.102
   2.774  -1.033   0.598
   1.383  -0.765   0.250
   0.244  -1.380   0.682
  -1.048  -0.752   0.249
  -2.079  -1.471  -0.331
  -3.252  -0.792  -0.640
  -3.358   0.566  -0.358
  -2.311   1.269   0.204
  -1.118   0.601   0.492
  -0.023   1.265   0.964
   1.064   1.697   0.028
   1.324   0.325  -0.762
   2.776   0.466  -1.275
A1A=AA2(A=A1)AAa1aaaaa21
  -3.076  -0.940   0.004
  -2.630  -0.429   1.160
  -1.521   0.321   1.230
  -0.714   0.618  -0.001
  -1.514   0.319  -1.236
  -2.640  -0.434  -1.162
  -0.272   2.062   0.001
   1.073   2.061   0.000
   1.599   0.768   0.000
   2.919   0.322  -0.001
   3.194  -1.030   0.000
   2.164  -1.952   0.001
   0.850  -1.518   0.001
   0.572  -0.169   0.000
a1aaa2a(a1)[aH]a1aaaaa21
  -3.420  -0.171   0.001
  -3.018   1.166   0.000
  -1.676   1.485   0.000
  -0.720   0.468   0.000
  -1.123  -0.877   0.000
  -2.480  -1.184   0.000
   0.010  -1.671   0.000
   1.144  -0.881  -0.001
   2.516  -1.164  -0.001
   3.377  -0.152   0.003
   2.961   1.101  -0.001
   1.684   1.416  -0.001
   0.751   0.464  -0.001
A1[AH2+]Aa2aa3aaaa3aa2A1
  -3.326   0.903  -0.395
  -3.391  -0.339   0.401
  -2.350  -1.274  -0.056
  -1.003  -0.600  -0.025
   0.137  -1.400  -0.051
   1.422  -0.781  -0.020
   2.733  -1.405  -0.034
   3.847  -0.587  -0.004
   3.152   1.053   0.045
   1.427   0.632   0.025
   0.321   1.338   0.043
  -0.877   0.777   0.021
  -2.086   1.679   0.050
A1=AA2=A(AA1)AAa1aaaaa21
   2.770  -1.477  -0.211
   1.452  -1.494  -0.194
   0.754  -0.371  -0.003
   1.416   0.834   0.186
   2.816   0.844   0.170
   3.469  -0.321  -0.035
   0.638   2.099   0.411
  -0.648   2.093  -0.412
  -1.414   0.817  -0.189
  -2.793   0.824  -0.177
  -3.490  -0.354   0.023
  -2.813  -1.546   0.213
  -1.432  -1.565   0.206
  -0.727  -0.382   0.006
A1Aa2aaa3aaaaa3a2[AH+]1
   3.073  -1.058   0.099
   2.990   0.286   0.058
   1.684   0.652   0.025
   1.064   1.905  -0.024
  -0.291   2.016  -0.044
  -1.096   0.864  -0.015
  -2.499   0.955  -0.036
  -3.248  -0.181  -0.008
  -2.646  -1.436   0.042
  -1.291  -1.562   0.064
  -0.485  -0.414   0.034
   0.921  -0.504   0.055
   1.825  -1.525  -0.253
a1aaa2aa3aa[aH+]a3aa2a1
   3.319   0.729  -0.005
   3.335  -0.664  -0.049
   2.177  -1.378  -0.053
   0.943  -0.705  -0.011
  -0.270  -1.417  -0.014
  -1.468  -0.721   0.027
  -2.886  -1.139   0.043
  -3.630   0.024   0.086
  -2.802   1.053  -0.244
  -1.484   0.690   0.073
  -0.299   1.397   0.077
   0.925   0.713   0.035
   2.145   1.416   0.037
a1aaa2a(AAAa3aaaaa23)a1
   3.472  -0.536  -0.079
   2.779  -1.634  -0.557
   1.399  -1.653  -0.516
   0.711  -0.564   0.007
   1.414   0.532   0.507
   0.656   1.686   1.104
   0.057   2.575   0.018
  -0.591   1.730  -1.076
  -1.408   0.619  -0.485
  -2.784   0.672  -0.446
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  -1.490  -1.530   0.479
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   2.792   0.544   0.454
A1A[A@@H]2A=AA[A@@H]2A1
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   1.508  -0.957  -0.174
   1.994   0.114   0.390
   0.982   1.235   0.394
  -0.092   0.809  -0.632
  -1.483   1.076  -0.036
A1A[A@H]2AA[A@@H](A1)A2
  -1.418   0.490   0.626
  -0.575   1.544  -0.102
   0.794   0.925  -0.435
   1.356   0.307   0.868
   0.766  -1.122   0.883
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   0.543  -0.215  -1.291
A1AAa2a(A1)aaa1A=AAAa21
   3.436  -0.388   0.376
   2.825  -1.568  -0.389
   1.366  -1.720   0.049
   0.682  -0.377   0.013
   1.404   0.802  -0.016
   2.762   0.806  -0.023
   0.740   2.032  -0.041
  -0.621   2.091  -0.041
  -1.366   0.907  -0.015
  -2.830   0.936  -0.014
  -3.494  -0.249   0.007
  -2.770  -1.458   0.040
  -1.428  -1.477   0.039
  -0.707  -0.335   0.012
A1=AA[A@@H]2AAA[A@H]2A1
   2.154  -0.642  -0.100
   2.154   0.642   0.099
   0.904   1.488   0.217
  -0.231   0.682  -0.377
  -1.636   1.130  -0.116
  -2.381   0.000   0.001
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  -0.231  -0.682   0.379
   0.904  -1.488  -0.217
A1[AH2+]AA2=A(AA=AA2)A1
   2.485  -0.748  -0.219
   2.381   0.550   0.484
   1.343   1.380  -0.147
   0.012   0.671  -0.151
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  -2.383  -0.648   0.245
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  -1.242   1.508  -0.236
   1.169  -1.461   0.010
A1AA[A@@H]2AA=A[A@H]2A1
  -2.179  -0.776  -0.258
  -2.264   0.704   0.104
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   0.260   0.750   0.409
   1.634   1.215  -0.077
   2.459  -0.067  -0.010
   1.667  -1.130  -0.069
   0.269  -0.670  -0.227
  -0.898  -1.441   0.315
A1AA[A@H]2AAAA[A@@H]2A1
   2.453  -0.789  -0.271
   2.504   0.639   0.274
   1.277   1.419  -0.207
   0.010   0.722   0.289
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  -2.481   0.735   0.267
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  -1.240  -1.340   0.164
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   1.179  -1.482   0.218
A1AAa2[aH]a3aaaaa3a2AA1
   2.984  -0.492   1.019
   3.249   0.884   0.444
   2.283   1.354  -0.615
   0.876   0.887  -0.343
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  -1.339   0.892   0.022
  -2.677   1.207   0.240
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   0.495  -0.441  -0.346
   1.332  -1.553  -0.507
   2.761  -1.575  -0.033
A1=Aa2a(AA1)aaa1aaaaa21
   2.742  -1.534   0.007
   1.423  -1.550  -0.003
   0.748  -0.401  -0.007
   1.441   0.829  -0.011
   2.779   0.830  -0.001
   3.437  -0.311   0.014
   0.719   2.044  -0.004
  -0.630   2.063   0.003
  -1.382   0.866   0.001
  -2.784   0.894   0.008
  -3.484  -0.277   0.007
  -2.827  -1.502  -0.000
  -1.463  -1.563  -0.006
  -0.718  -0.382  -0.006
A1=AAa2a(=A1)aa1aaaaa21
   3.517   0.083  -0.000
   2.891   1.296  -0.000
   1.501   1.385   0.001
   0.706   0.275  -0.000
   1.331  -0.937  -0.000
   2.713  -1.077  -0.000
  -0.002  -2.113  -0.001
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  -2.715  -1.070   0.005
  -3.499   0.070  -0.001
  -2.885   1.312  -0.001
  -1.516   1.431  -0.000
  -0.695   0.290  -0.000
A1[AH2+]AA2=A(A=AAA2)A1
  -2.453  -0.699   0.404
  -2.436   0.592  -0.325
  -1.300   1.413   0.137
   0.002   0.683  -0.040
   0.059  -0.662  -0.079
   1.252  -1.315  -0.198
   2.395  -0.692  -0.033
   2.393   0.645   0.305
   1.283   1.479  -0.176
  -1.196  -1.443   0.004
A1AA[A+]2=A(A1)[AH+]AA2
   2.418   0.029   0.398
   1.940  -1.142  -0.470
   0.593  -1.633   0.044
  -0.409  -0.561   0.055
  -0.198   0.724   0.046
   1.408   1.477  -0.009
  -1.379   1.386  -0.270
  -2.511   0.557   0.113
  -1.859  -0.835   0.091
A1AAA2=A(A1)A=A1AAAA1A2
   3.426   1.009   0.289
   3.486  -0.334  -0.453
   2.401  -1.256   0.098
   1.049  -0.602   0.052
   0.892   0.733   0.010
   2.073   1.623  -0.005
  -0.357   1.281  -0.023
  -1.461   0.601  -0.013
  -3.164   1.130  -0.044
  -3.939  -0.533  -0.011
  -2.702  -1.406   0.023
  -1.514  -0.782   0.021
  -0.191  -1.468   0.053
A1AAA2=A(A1)Aa1aaaaa1A2
   3.633   0.712   0.446
   3.762  -0.626  -0.294
   2.511  -1.426   0.005
   1.227  -0.720  -0.009
   1.179   0.661  -0.056
   2.441   1.483  -0.113
  -0.001   1.309  -0.057
  -1.219   0.671  -0.024
  -2.403   1.406  -0.032
  -3.617   0.757  -0.001
  -3.680  -0.630   0.035
  -2.522  -1.377   0.050
  -1.287  -0.732   0.018
  -0.024  -1.493   0.029
A1A[A@H]2Aa3aaaaa3AA2A1
  -3.449   0.026   0.446
  -2.901   1.084  -0.186
  -1.540   0.620  -0.664
  -0.433   1.422   0.019
   0.867   0.660   0.027
   2.034   1.405   0.166
   3.265   0.787   0.198
   3.348  -0.590   0.094
   2.194  -1.332  -0.050
   0.954  -0.708  -0.091
  -0.257  -1.582  -0.276
  -1.458  -0.761  -0.137
  -2.622  -1.029   0.455
A1=Aa2[aH]a3aaaaa3a2AA1
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  -2.495  -1.205   0.001
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   3.022   1.182   0.000
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A1AA[A@@H]2AAA[A@@H]2A1
   2.174  -0.762   0.024
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A1AAA2=A(A1)a1aaaaa1AA2
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A1A[AH+]a2aaaaa2[AH+]A1
   2.074  -0.001   1.052
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  -1.404   1.373   0.065
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A1AA[A@H]2AA=AA[A@H]2A1
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a1aaa2a(a1)AA1=A2A=AAA1
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a1aaa2a(a1)aa1aa[aH]a21
   3.249  -0.092   0.000
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A1A[A@@H]2AA[A@H](A1)A2
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a1aaa2a(a1)[aH]a1aaaa21
   3.130  -0.156   0.000
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A1AAa2aa3aaaaa3[a+]a2A1
   3.596   0.693   0.445
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a1aaa2aa3aaaaa3[a+]a2a1
  -3.565   0.726   0.006
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   2.381   1.424  -0.001
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  -0.000   1.372  -0.005
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A1Aa2aa3aaa4aaaa4a3a2A1
  -3.263   1.965  -0.306
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   3.453   0.332  -0.024
   3.032   1.582   0.020
   1.694   1.597   0.042
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a1aa2aaaa3[aH]aa(a1)a23
   0.435   2.654  -0.001
   1.456   1.750  -0.001
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  -0.903   2.240   0.000
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A1A[A@H]2AAa3aaaaa3A2A1
   2.986  -1.107  -0.253
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   1.160   1.868  -0.349
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A1AAAA2Aa3aaaaa3A=A2AA1
  -3.432  -0.807  -0.707
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  -1.505   1.818  -0.006
  -0.700   0.777   0.667
   0.534   1.255   1.031
   1.686   0.513   0.472
   2.894   1.048   0.424
   3.892   0.432  -0.191
   3.714  -0.813  -0.810
   2.491  -1.429  -0.748
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A1=AA2=Aa3aaaaa3AA2=AA1
  -3.584  -0.736   0.000
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   1.153  -0.698   0.000
   2.372  -1.405   0.001
   3.552  -0.724   0.000
   3.568   0.667  -0.001
   2.391   1.383  -0.001
   1.172   0.715  -0.001
   0.017   1.417   0.004
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A1A[A@@H]2Aa3aaaaa3A2A1
  -3.261   0.579   0.203
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   0.790  -0.859   0.048
   2.119  -1.234   0.171
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   2.794   1.057  -0.024
   1.471   1.444  -0.128
   0.463   0.495  -0.074
  -0.937   0.615  -0.096
  -1.991   1.403   0.164
A1=AAa2a(=A1)aa1AAAAa21
  -3.498   0.022   0.002
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  -1.336   0.906  -0.016
  -2.644   1.034  -0.022
  -0.053   2.069  -0.044
   1.302   0.927  -0.014
   2.767   1.222  -0.020
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   2.955  -1.230  -0.423
   1.535  -1.550   0.047
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A1=AA[A@H]2AAA[A@@H]2A1
   2.160   0.636  -0.102
   2.154  -0.647   0.100
   0.900  -1.488   0.222
  -0.232  -0.678  -0.374
  -1.639  -1.130  -0.120
  -2.385  -0.001  -0.004
  -1.643   1.129   0.122
  -0.226   0.691   0.379
   0.914   1.488  -0.221
a1aaa2[AH+]Aa3aaaa3a2a1
  -2.724  -1.381  -0.122
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  -2.461   1.001   0.086
  -1.086   0.853   0.108
  -0.262   2.016   0.279
   1.117   1.935  -0.337
   1.709   0.611  -0.133
   3.042   0.227  -0.059
   3.091  -1.073   0.120
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A1AAA2=[A+](A1)AA[AH+]2
   2.171   0.661   0.324
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  -0.253   0.652  -0.027
   0.964   1.468  -0.157
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A1AA[A@@H]2AAAA[A@H]2A1
  -2.493   0.722   0.277
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   2.444   0.669   0.177
   1.255   1.458  -0.172
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A1AAA2(AA1)AAa1aaaaa1A2
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   3.643   0.442  -0.334
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A1AA2Aa3aaaaa3[A@@H]2A1
   3.024   0.725  -0.541
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   1.013   0.446   0.568
   1.764   1.356  -0.237
a1aaa2aa3=AA=A[a+]3a2a1
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   1.666   0.781   0.030
   2.942   0.534   0.041
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a1[aH]a2A=a3aaaaa3Aa2a1
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   3.283   0.643   0.001
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  -2.800   1.141  -0.000
A1AA2=A(A1)a1aaaaa1AA2
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  -0.897   0.484   0.001
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   3.292   0.132   0.000
   2.506  -1.009   0.000
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A1Aa2aa3[a+]aaaa3aa2A1
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   2.791   1.103   0.087
A1=AA2AAAa3aaaa(A1)a23
   2.739   0.688  -0.035
   1.740   1.636   0.042
   0.438   1.315   0.093
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A1AAA2(AA1)AAa1aaaaa21
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  -1.451   0.433  -1.494
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   3.606   0.497  -0.014
   2.832   1.661  -0.041
   1.437   1.561  -0.033
   0.841   0.324  -0.008
A1=AAa2a(A1)aa1aaaaa21
   3.402   0.078   0.001
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   0.691  -0.417  -0.001
   1.159   0.866  -0.000
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a1aaa2AAa3a[aH]aa3a2a1
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   1.069  -1.995  -0.380
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   3.025  -0.316  -0.097
   3.089   1.031   0.103
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   0.958   0.525   0.035
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A1A[A@@H]2AAA[A@@H]2A1
   1.894  -0.101   0.628
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a1aaa2a(a1)AAa1aaaaa21
   3.526  -0.243  -0.000
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   1.409   0.867   0.001
   2.804   0.916  -0.000
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A1=A[A@@H]2AA[A@@H]2A1
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   0.191   0.848   0.520
   1.142   0.803  -0.686
   1.784  -0.417  -0.063
   0.475  -0.673   0.648
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a1aaa2aa3aaaa3[a+]a2a1
   3.282  -0.557  -0.002
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   2.128   1.540   0.001
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A1AA[AH+]2AAA[A@@H]2A1
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   1.598   1.199   0.007
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a1aaa2[aH+]a3aaaa3a2a1
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   3.148   0.573  -0.012
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   0.955   0.510  -0.004
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  -1.416   1.442   0.056
A1AAA2=AAa3aaaaa3A2AA1
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  -1.068   1.042  -0.022
  -0.327   2.216  -0.125
   1.139   2.160  -0.134
   1.752   0.823  -0.048
   3.137   0.658  -0.064
   3.668  -0.599   0.016
   2.838  -1.708   0.111
   1.466  -1.563   0.129
   0.906  -0.289   0.053
  -0.478  -0.148   0.085
  -1.229  -1.397   0.265
  -2.324  -1.551  -0.791
A1AAa2a(A1)aa1A=AAAa21
  -3.531  -0.096  -0.387
  -2.965  -1.266   0.423
  -1.544  -1.583  -0.045
  -0.718  -0.300  -0.014
  -1.320   0.908   0.015
  -2.792   1.188   0.020
   0.007   2.083   0.044
   1.369   0.946   0.017
   2.693   1.075   0.025
   3.470   0.026  -0.005
   2.955  -1.230  -0.035
   1.626  -1.442  -0.040
   0.744  -0.311  -0.014
A1AA[A@@H]2AAA[A@H]2A1
  -2.192   0.736   0.190
  -2.188  -0.739  -0.197
  -0.910  -1.456   0.283
   0.251  -0.706  -0.332
   1.650  -1.137  -0.024
   2.397  -0.000  -0.002
   1.650   1.137   0.026
   0.252   0.706   0.327
  -0.913   1.459  -0.271
A1AAA2(AA1)AAA[AH2+]A2
  -2.757   0.312   0.222
  -1.812   1.204   0.793
  -0.458   0.560   1.046
   0.001  -0.413  -0.025
  -1.143  -1.312  -0.494
  -2.330  -0.440  -0.908
   1.101  -1.314   0.570
   2.284  -0.441   0.994
   2.802   0.339  -0.217
   1.710   1.179  -0.752
   0.601   0.324  -1.224
A1AA[A@@H]2AAA[AH+]2A1
  -2.173   0.745   0.277
  -2.215  -0.715  -0.175
  -0.932  -1.437   0.213
   0.245  -0.668  -0.372
   1.620  -1.235  -0.003
   2.521   0.017   0.142
   1.572   1.222  -0.093
   0.267   0.630   0.249
  -0.904   1.437  -0.242
A1=AA[A@H]2AAA[A@H]2A1
  -1.753  -0.905   0.519
  -2.139   0.293   0.228
  -1.272   1.288  -0.477
   0.168   0.874  -0.547
   0.964   1.082   0.749
   2.179   0.253   0.548
   1.873  -0.796  -0.446
   0.371  -0.633  -0.808
  -0.395  -1.452   0.235
A1AAA2=A(A1)[AH+]A=AA2
   2.382   0.707   0.479
   2.523  -0.670  -0.176
   1.210  -1.396  -0.081
  -0.003  -0.703  -0.045
  -0.034   0.668  -0.102
   1.248   1.462  -0.217
  -1.186   1.346  -0.058
  -2.384   0.733   0.039
  -2.483  -0.635   0.099
  -1.270  -1.513   0.060
A1AA[A@H]2AAA[A@@H]2A1
  -2.188   0.737  -0.203
  -2.190  -0.738   0.183
  -0.917  -1.453  -0.260
   0.253  -0.704   0.333
   1.648  -1.139   0.018
   2.398  -0.003  -0.008
   1.654   1.136  -0.019
   0.252   0.709  -0.325
  -0.914   1.456   0.284
A1AAA2(AA1)AA[AH2+]AA2
  -2.785   0.409  -0.264
  -2.330  -0.491   0.887
  -1.164  -1.365   0.420
  -0.003  -0.472  -0.020
  -0.457   0.428  -1.170
  -1.623   1.302  -0.704
   1.166  -1.344  -0.484
   2.346  -0.446  -0.866
   2.750   0.343   0.317
   1.650   1.242   0.728
   0.451   0.394   1.158
A1A[A@H]2AAAA[A@@H]2A1
   2.467   0.253  -0.005
   1.468   1.440  -0.067
   0.166   0.767   0.406
  -1.021   1.338  -0.157
  -2.399   0.465   0.027
  -1.996  -1.096  -0.166
  -0.706  -1.576   0.285
   0.333  -0.622  -0.266
   1.691  -0.965  -0.055
A1AAa2a(A1)aaa1AAAAa21
  -3.454   0.364   0.388
  -2.752   1.479  -0.398
  -1.376   1.501  -0.016
  -0.697   0.323  -0.014
  -1.352  -0.895  -0.021
  -2.857  -0.978  -0.043
  -0.621  -2.072  -0.008
   0.759  -2.038   0.009
   1.424  -0.820   0.013
   2.785  -0.801   0.033
   3.417   0.428  -0.340
   2.705   1.575   0.391
   1.327   1.569   0.000
   0.697   0.361   0.000
A1AAa2aa3[AH+]AAa3a2A1
  -2.763   1.050  -0.054
  -3.088  -0.254  -0.024
  -2.147  -1.216   0.012
  -0.804  -0.873   0.033
   0.325  -1.577   0.073
   1.374  -0.761   0.076
   2.725  -0.766  -0.248
   3.308   0.524   0.088
   2.073   1.440   0.040
   0.930   0.517   0.037
  -0.458   0.472   0.008
  -1.473   1.444  -0.036
A1=Aa2aaaa3aaaa(A1)a23
  -2.728  -0.699  -0.003
  -2.357   0.605   0.000
  -0.997   0.985   0.001
  -0.627   2.337   0.001
   0.703   2.699   0.000
   1.711   1.743  -0.001
   1.374   0.368  -0.001
   2.357  -0.629  -0.001
   1.994  -1.960  -0.000
   0.662  -2.339   0.001
  -0.339  -1.372   0.001
  -1.765  -1.732   0.002
   0.012  -0.006   0.000
a1aaa2a(a1)aaa1aaaaa21
   3.501  -0.310   0.000
   2.830  -1.527  -0.000
   1.465  -1.572  -0.001
   0.734  -0.382  -0.000
   1.413   0.858   0.000
   2.815   0.869   0.001
   0.675   2.064   0.000
  -0.674   2.064   0.001
  -1.411   0.857  -0.000
  -2.814   0.870  -0.001
  -3.505  -0.307  -0.001
  -2.837  -1.527   0.004
  -1.461  -1.573  -0.002
  -0.732  -0.382  -0.001
a1aaa2Aa3aaaaa3AAAa2a1
   3.685  -0.023   0.748
   3.530  -1.109  -0.094
   2.321  -1.321  -0.737
   1.282  -0.447  -0.530
   0.089  -0.463  -1.270
  -1.116  -0.542  -0.558
  -1.562  -1.753  -0.049
  -2.731  -1.793   0.692
  -3.454  -0.636   0.925
  -3.016   0.573   0.409
  -1.856   0.610  -0.335
  -1.387   1.770  -0.886
  -0.145   2.278  -0.358
   0.320   1.392   0.674
   1.411   0.625   0.377
   2.632   0.842   0.985
A1AAA2=A(A1)A[AH2+]AA2
  -2.457  -0.718  -0.366
  -2.484   0.640   0.350
  -1.294   1.449  -0.151
  -0.010   0.652  -0.066
   0.014  -0.641   0.063
  -1.241  -1.483   0.142
   1.312  -1.417   0.159
   2.443  -0.630  -0.327
   2.458   0.677   0.352
   1.260   1.474  -0.153
a1aaa2Aa3aaaaa3=AAa2a1
   3.590  -0.080  -0.834
   3.306   1.226  -0.473
   2.133   1.520   0.198
   1.239   0.515   0.510
  -0.020   0.836   1.261
  -1.206   0.510   0.476
  -2.018   1.537   0.096
  -3.194   1.309  -0.534
  -3.585  -0.005  -0.820
  -2.756  -1.033  -0.481
  -1.522  -0.769   0.143
  -0.735  -1.797   0.428
   0.558  -1.881   0.428
   1.509  -0.798   0.140
   2.702  -1.090  -0.536
A1=Aa2a(AA1)aaa1aaaa21
   2.568  -1.574   0.055
   1.265  -1.650  -0.210
   0.464  -0.411  -0.120
   1.132   0.818  -0.112
   2.489   0.824  -0.187
   3.180  -0.254   0.445
   0.415   2.003  -0.036
  -0.961   1.977   0.044
  -1.641   0.758   0.038
  -3.058   0.376   0.102
  -3.086  -0.963   0.057
  -1.835  -1.449  -0.029
  -0.931  -0.450  -0.044
A1A[A@H]2A=AA[A@@H]2A1
  -2.221   0.034  -0.074
  -1.307  -1.202  -0.067
   0.010  -0.685   0.329
   1.356  -1.163  -0.014
   2.095  -0.087  -0.099
   1.310   1.103   0.129
   0.039   0.736  -0.364
  -1.283   1.261   0.158
A1AAa2a(A1)aa1AA=AAa21
   3.531  -0.099   0.387
   2.963  -1.268  -0.424
   1.543  -1.584   0.045
   0.715  -0.303   0.014
   1.322   0.908  -0.014
   2.794   1.185  -0.018
  -0.003   2.089  -0.044
  -1.357   0.960  -0.018
  -2.708   1.120  -0.023
  -3.465  -0.016   0.005
  -2.962  -1.214   0.034
  -1.635  -1.483   0.041
  -0.736  -0.301   0.013
a1aaa2A=Aa3aaaaa3Aa2a1
   3.363  -0.997   0.914
   3.549   0.372   0.943
   2.657   1.212   0.308
   1.552   0.684  -0.373
   0.698   1.538  -0.990
  -0.570   1.589  -1.002
  -1.542   0.702  -0.361
  -2.646   1.251   0.301
  -3.567   0.427   0.914
  -3.411  -0.947   0.883
  -2.327  -1.507   0.231
  -1.395  -0.691  -0.390
  -0.015  -1.401  -1.226
   1.372  -0.702  -0.392
   2.275  -1.533   0.246
a1aaa2AAa3aa[aH]a3a2a1
   2.653  -1.486   0.001
   3.263  -0.241   0.001
   2.506   0.911   0.000
   1.117   0.833   0.000
   0.356   1.987  -0.000
  -0.988   1.954  -0.001
  -1.705   0.675  -0.000
  -3.006   0.346  -0.000
  -3.139  -0.934   0.000
  -1.866  -1.526   0.001
  -0.966  -0.509   0.001
   0.499  -0.429   0.001
   1.280  -1.587  -0.004
A1AA2AA=Aa3aaaa(A1)a23
  -2.736  -0.271   0.496
  -2.030  -1.440  -0.195
  -0.581  -1.269  -0.098
   0.215  -2.360  -0.050
   1.668  -2.185   0.037
   2.179  -0.988   0.070
   1.395   0.106   0.027
   1.978   1.382   0.064
   1.190   2.495   0.024
  -0.191   2.377  -0.052
  -0.788   1.135  -0.091
  -2.290   1.035  -0.170
  -0.007  -0.016  -0.056
A1AAa2a(AA1)aa1aaaaa21
   3.439   0.663   0.386
   2.283   1.624   0.511
   1.316   1.491  -0.671
   0.439   0.330  -0.398
   0.871  -0.953  -0.322
   2.316  -1.389  -0.523
   3.128  -0.794   0.635
  -0.177  -1.782  -0.060
  -1.370  -0.922   0.042
  -2.719  -1.165   0.292
  -3.608  -0.114   0.322
  -3.166   1.184   0.104
  -1.835   1.439  -0.144
  -0.921   0.391  -0.179
a1aaa2Aa3aa[aH]a3Aa2a1
   3.386  -0.690  -0.000
   3.386   0.692   0.000
   2.192   1.393   0.001
   0.984   0.703   0.000
  -0.300   1.438   0.000
  -1.576   0.688  -0.000
  -2.854   1.085  -0.001
  -3.643   0.029  -0.002
  -2.880  -1.101   0.004
  -1.567  -0.700  -0.001
  -0.300  -1.439  -0.001
   0.984  -0.703  -0.000
   2.192  -1.392  -0.000
A1AAa2a(=A1)aa1aaaaa21
  -3.519  -0.048  -0.219
  -2.908  -1.289   0.437
  -1.494  -1.479  -0.078
  -0.686  -0.313  -0.053
  -1.339   0.914  -0.036
  -2.614   1.101  -0.080
  -0.017   2.093   0.052
   1.328   0.946   0.032
   2.689   1.132   0.065
   3.472  -0.019   0.026
   2.884  -1.267  -0.043
   1.516  -1.455  -0.074
   0.694  -0.312  -0.035
A1AAA2=A(A1)Aa1aaaa1A2
  -3.266  -0.760   0.505
  -3.347   0.642   0.100
  -2.231   1.343  -0.185
  -0.915   0.660  -0.128
  -0.874  -0.700  -0.161
  -2.157  -1.480  -0.258
   0.372  -1.365  -0.097
   1.510  -0.646  -0.018
   2.856  -1.029   0.052
   3.595   0.060   0.121
   2.742   1.176   0.098
   1.462   0.720   0.012
   0.248   1.378  -0.043
A1A[A@@H]2A=AA[A@H]2A1
   2.220   0.038  -0.069
   1.310  -1.200  -0.062
  -0.009  -0.687   0.332
  -1.353  -1.163  -0.021
  -2.093  -0.087  -0.099
  -1.309   1.102   0.140
  -0.044   0.730  -0.368
   1.278   1.265   0.149
a1aaa2A=A3AAA[A+]3a2a1
   2.761   1.144  -0.023
   3.161  -0.192  -0.003
   2.223  -1.200   0.004
   0.858  -0.879  -0.017
  -0.321  -1.656  -0.010
  -1.389  -0.798  -0.029
  -2.854  -0.823  -0.040
  -3.327   0.612  -0.062
  -2.041   1.450  -0.064
  -0.956   0.395   0.311
   0.461   0.470  -0.032
   1.425   1.474  -0.038
A1AAA2Aa3aaaaa3A=A2AA1
  -3.880  -0.048  -0.627
  -3.054   1.227  -0.646
  -2.227   1.366   0.630
  -0.927   0.712   0.433
   0.189   1.447   0.254
   1.455   0.721   0.057
   2.661   1.389  -0.146
   3.812   0.674  -0.320
   3.790  -0.726  -0.306
   2.598  -1.411  -0.105
   1.416  -0.691   0.079
   0.228  -1.315   0.277
  -0.878  -0.654   0.438
  -2.179  -1.404   0.630
  -3.011  -1.294  -0.644
[AH2+]1AAa2aa[a+]aa2A1
   2.383  -0.671  -0.376
   2.447   0.589   0.392
   1.292   1.479  -0.071
   0.003   0.704  -0.035
  -1.217   1.398  -0.076
  -2.417   0.667  -0.045
  -2.460  -0.694   0.021
  -1.252  -1.327   0.060
  -0.020  -0.667   0.036
   1.245  -1.480   0.092
a1aaa2aaa3aa[a+]a3a2a1
  -2.642   1.437  -0.001
  -3.269   0.195  -0.001
  -2.544  -0.958   0.000
  -1.139  -0.896  -0.001
  -0.369  -2.077   0.000
   0.990  -2.003   0.001
   1.644  -0.786   0.000
   3.349  -0.285   0.000
   3.061   1.480  -0.001
   1.737   1.543  -0.001
   0.967   0.449  -0.001
  -0.508   0.366  -0.001
  -1.281   1.532   0.004
A1AA[A@H]2AA=A[A@H]2A1
   2.272   0.246   0.110
   1.745  -1.062   0.723
   0.768  -1.660  -0.285
  -0.292  -0.708  -0.723
  -1.882  -0.999   0.128
  -2.332   0.688   0.485
  -1.304   1.459   0.012
  -0.105   0.783  -0.593
   1.134   1.256   0.142
A1AAA2(AA1)Aa1aaaaa1A2
  -3.688   0.506   0.350
  -3.179   0.164  -1.052
  -2.136  -0.953  -0.956
  -0.983  -0.500  -0.070
  -1.476  -0.129   1.323
  -2.521   0.985   1.216
   0.086  -1.608   0.021
   1.369  -0.799   0.041
   2.664  -1.129   0.374
   3.668  -0.176   0.310
   3.372   1.111  -0.090
   2.063   1.455  -0.432
   1.045   0.487  -0.369
  -0.278   0.592  -0.669
A1AAa2aa3aaaa3[a+]a2A1
  -3.340  -0.918   0.394
  -3.439   0.386  -0.407
  -2.322   1.320   0.053
  -0.992   0.612   0.021
   0.157   1.397   0.046
   1.430   0.772   0.022
   2.752   1.378   0.040
   3.835   0.589   0.017
   3.150  -1.056  -0.032
   1.424  -0.638  -0.021
   0.317  -1.418  -0.045
  -0.885  -0.762  -0.024
  -2.089  -1.667  -0.060
A1AAa2a(A1)aa1AAA=Aa21
  -3.540  -0.074   0.311
  -2.953  -1.265  -0.452
  -1.552  -1.582   0.077
  -0.718  -0.306   0.056
  -1.310   0.908  -0.026
  -2.778   1.196  -0.095
   0.030   2.070  -0.026
   1.336   0.970   0.073
   2.699   1.135   0.111
   3.507  -0.004  -0.363
   2.908  -1.279   0.010
   1.632  -1.473   0.208
   0.733  -0.294   0.111
a1aaa2Aa3aaaaa3A=Aa2a1
  -3.495  -0.048   0.922
  -3.162  -1.338   0.510
  -1.997  -1.553  -0.222
  -1.159  -0.481  -0.547
   0.001  -0.734  -1.271
   1.161  -0.481  -0.548
   2.005  -1.550  -0.229
   3.169  -1.333   0.503
   3.495  -0.043   0.923
   2.657   1.023   0.603
   1.491   0.806  -0.137
   0.643   1.953  -0.478
  -0.649   1.954  -0.482
  -1.496   0.805  -0.144
  -2.663   1.021   0.596
A1AA2A=AAa3aaaa(A1)a23
  -1.890   2.064   0.438
  -2.330   0.791  -0.286
  -1.339  -0.280  -0.114
  -1.808  -1.542  -0.019
  -0.985  -2.640   0.076
   0.473  -2.436   0.082
   0.950  -1.044   0.022
   2.321  -0.761   0.035
   2.767   0.528  -0.006
   1.854   1.585  -0.053
   0.479   1.321  -0.056
  -0.498   2.417  -0.055
   0.005  -0.008  -0.058
A1=A[A@@H]2A=AA=A2A=A1
   1.906   0.749   0.303
   0.791   1.427   0.091
  -0.344   0.704  -0.579
  -1.668   1.029  -0.059
  -2.190  -0.099   0.337
  -1.360  -1.141   0.207
  -0.185  -0.764  -0.208
   1.011  -1.349  -0.179
   2.039  -0.552   0.089
a1aaa2aa3AAAa3[a+]a2a1
   3.305   0.718  -0.000
   3.335  -0.673   0.001
   2.179  -1.395   0.000
   0.946  -0.729  -0.000
  -0.275  -1.447  -0.001
  -1.466  -0.708   0.000
  -2.878  -1.111   0.000
  -3.674  -0.028  -0.000
  -2.838   1.177   0.000
  -1.404   0.697   0.000
  -0.263   1.415   0.000
   0.912   0.685  -0.000
   2.123   1.395  -0.000
A1A=A[A@H]2AAA[A@H]2A1
  -2.015   0.960  -0.246
  -2.149  -0.530  -0.106
  -1.166  -1.295   0.246
   0.216  -0.831   0.557
   1.196  -1.185  -0.582
   2.358  -0.185  -0.408
   1.791   1.018   0.366
   0.304   0.705   0.642
  -0.535   1.342  -0.470
A1A=Aa2a(A1)aa1aaaaa21
  -3.495  -0.077  -0.001
  -2.893   1.186  -0.000
  -1.624   1.345  -0.000
  -0.756   0.296  -0.001
  -1.312  -0.982  -0.001
  -2.701  -1.176   0.005
   0.079  -2.081  -0.001
   1.387  -0.880  -0.000
   2.700  -0.974  -0.000
   3.466   0.100   0.001
   2.900   1.365   0.001
   1.532   1.514  -0.000
   0.717   0.358  -0.000
A1AA2=A(A1)Aa1aaaaa1A2
   3.823   0.507  -0.001
   2.765   1.335  -0.000
   1.474   0.772  -0.000
   1.461  -0.632   0.004
   3.134  -1.055  -0.001
   0.322  -1.362  -0.001
  -0.930  -0.776  -0.000
  -2.075  -1.561  -0.000
  -3.324  -0.959  -0.000
  -3.437   0.433  -0.000
  -2.319   1.217  -0.000
  -1.052   0.625  -0.000
   0.163   1.454  -0.000
A1AA2Aa3aaaaa3[A@H]2A1
  -3.345   0.224  -0.639
  -2.850  -1.016   0.158
  -1.381  -0.986   0.252
  -0.266  -1.686  -0.020
   0.898  -0.779  -0.079
   2.223  -0.975  -0.468
   3.111   0.080  -0.442
   2.694   1.332  -0.024
   1.386   1.530   0.382
   0.493   0.483   0.369
  -0.948   0.345   0.764
  -2.015   1.444  -0.255
a1aaa2a(a1)aa1AAA=Aa21
  -3.408  -0.179   0.000
  -3.019   1.153  -0.001
  -1.682   1.485   0.000
  -0.720   0.477   0.000
  -1.111  -0.872   0.001
  -2.466  -1.185   0.000
   0.001  -1.636   0.001
   1.117  -0.877   0.001
   2.495  -1.191  -0.004
   3.386  -0.176   0.001
   2.963   1.112   0.000
   1.696   1.419   0.000
   0.750   0.465   0.000
a1aaa2AA3(AAA=A3)Aa2a1
   3.393  -0.772   0.075
   3.450   0.610   0.027
   2.290   1.350  -0.015
   1.044   0.704  -0.010
  -0.317   1.269  -0.050
  -1.288   0.124  -0.032
  -2.173   0.131  -1.294
  -3.513  -0.348  -0.680
  -3.386  -0.030   0.750
  -2.223   0.214   1.085
  -0.445  -1.147   0.032
   0.997  -0.690   0.032
   2.170  -1.418   0.081
A1A[A@H]2Aa3aaaaa3A2A1
  -2.913   0.525  -0.704
  -2.876  -0.508   0.161
  -1.551  -0.587   0.782
  -0.661  -1.556  -0.027
   0.675  -0.842  -0.059
   1.945  -1.290  -0.355
   3.018  -0.418  -0.303
   2.814   0.905   0.047
   1.545   1.358   0.340
   0.460   0.483   0.280
  -0.896   0.725   0.534
  -1.562   1.205  -0.699
[A+]1=A[A@H]2A[A@H]2A1
  -1.480   0.006  -0.218
  -0.807  -1.074   0.004
   0.617  -0.798   0.415
   1.567  -0.083  -0.598
   0.753   0.737   0.405
  -0.652   1.210  -0.009
a1aaa2AAA3(AAAA3)Aa2a1
   3.112   1.320  -0.053
   3.506   0.087  -0.535
   2.627  -0.987  -0.501
   1.344  -0.808   0.023
   0.378  -1.922   0.087
  -0.937  -1.639   0.195
  -1.407  -0.258   0.251
  -1.567   0.298  -1.173
  -3.057   0.667  -1.336
  -3.554   0.888   0.114
  -2.801  -0.211   0.906
  -0.439   0.620   1.048
   0.956   0.447   0.504
   1.839   1.500   0.467
A1AA[A@H]2AAAA[A@H]2A1
  -2.086   1.023  -0.466
  -2.256  -0.498  -0.473
  -1.581  -1.063   0.747
  -0.090  -0.735   0.742
   0.578  -1.347  -0.489
   2.080  -1.055  -0.451
   2.306   0.459  -0.467
   1.542   1.067   0.631
   0.101   0.779   0.726
  -0.596   1.366  -0.504
a1aaa2a(a1)aa1AAAAa21
   3.408  -0.126   0.002
   2.927   1.190   0.047
   1.598   1.432   0.053
   0.698   0.403   0.017
   1.148  -0.895  -0.027
   2.521  -1.165  -0.035
   0.014  -1.735  -0.057
  -1.110  -0.884  -0.032
  -2.564  -1.285  -0.049
  -3.403  -0.083   0.402
  -2.983   1.156  -0.394
  -1.582   1.597   0.054
  -0.669   0.393   0.016
A1Aa2aaaa3aaaa(A1)a23
   2.810   0.000   0.001
   2.161   1.181   0.001
   0.691   1.221   0.001
  -0.017   2.413  -0.000
  -1.407   2.400  -0.001
  -2.111   1.230  -0.000
  -1.431   0.000  -0.000
  -2.111  -1.231  -0.000
  -1.406  -2.401  -0.000
  -0.016  -2.414   0.001
   0.692  -1.221   0.001
   2.161  -1.180  -0.004
  -0.021   0.000   0.001
A1AAa2aa3aaaaa3aa2AA1
   3.898   0.000   0.463
   3.060   1.264   0.585
   2.140   1.370  -0.502
   0.959   0.698  -0.355
  -0.216   1.404  -0.209
  -1.433   0.708  -0.061
  -2.648   1.397   0.087
  -3.808   0.698   0.225
  -3.809  -0.697   0.222
  -2.649  -1.397   0.083
  -1.433  -0.709  -0.062
  -0.216  -1.405  -0.208
   0.959  -0.699  -0.353
   2.140  -1.371  -0.500
   3.060  -1.263   0.587
A1AA[A@@H]2AA=AA=A2A1
  -2.421   0.706   0.400
  -2.518  -0.673  -0.261
  -1.209  -1.393  -0.083
  -0.000  -0.686   0.038
   1.270  -1.475   0.235
   2.477  -0.638  -0.074
   2.402   0.703  -0.128
   1.212   1.338   0.102
   0.027   0.662  -0.017
  -1.239   1.458  -0.210
A1AAA2=Aa3aaaa3AA2AA1
  -3.638  -0.275   0.640
  -2.722  -1.486   0.633
  -1.883  -1.534  -0.644
  -0.620  -0.733  -0.431
   0.527  -1.328  -0.272
   1.642  -0.628  -0.080
   3.345  -1.055   0.177
   4.025   0.585   0.339
   2.943   1.389   0.192
   1.640   0.775  -0.036
   0.365   1.401  -0.220
  -0.718   0.630  -0.406
  -2.045   1.234  -0.585
  -2.864   1.031   0.688
a1aaa2a(a1)aa1aaaaa21
  -3.535  -0.022  -0.000
  -2.963  -1.285  -0.000
  -1.601  -1.449   0.001
  -0.741  -0.329   0.001
  -1.348   0.936   0.001
  -2.720   1.093  -0.004
   0.007   2.082   0.001
   1.355   0.930   0.001
   2.732   1.060  -0.000
   3.499  -0.009  -0.001
   2.976  -1.234  -0.001
   1.605  -1.443   0.001
   0.736  -0.333   0.001
A1AAa2aa3A=AAAa3a2AA1
  -3.688  -0.721   0.254
  -3.232   0.611   0.841
  -2.447   1.369  -0.237
  -0.998   1.001  -0.146
   0.387   2.109  -0.117
   1.688   0.907  -0.022
   3.012   0.974   0.034
   3.741  -0.121   0.099
   3.154  -1.356   0.111
   1.816  -1.493   0.058
   1.000  -0.317  -0.012
  -0.462  -0.236  -0.073
  -1.323  -1.495  -0.049
  -2.653  -1.234  -0.746
a1aaa2a(a1)Aa1aaaaa21
  -3.465   0.112  -0.001
  -3.014  -1.195   0.005
  -1.662  -1.464  -0.003
  -0.742  -0.414  -0.001
  -1.206   0.899  -0.001
  -2.560   1.158  -0.001
  -0.000   1.807   0.000
   1.205   0.899   0.000
   2.560   1.158   0.001
   3.465   0.112   0.001
   3.015  -1.195   0.000
   1.662  -1.464  -0.001
   0.742  -0.414   0.000
A1A[A@@H]2A=A[A@H]1A2
  -1.237   0.762   0.518
  -1.214  -0.775   0.510
   0.018  -1.140  -0.334
   1.209  -0.680   0.515
   1.213   0.676   0.521
   0.022   1.148  -0.323
  -0.012   0.009  -1.406
a1aaa2Aa3aaaaa3AAa2a1
   3.938  -0.258   0.091
   3.686   1.103   0.106
   2.387   1.534   0.034
   1.308   0.628  -0.063
  -0.001   1.311  -0.016
  -1.312   0.629   0.033
  -2.393   1.533  -0.043
  -3.693   1.098  -0.074
  -3.939  -0.263  -0.040
  -2.882  -1.130   0.057
  -1.544  -0.675   0.130
  -0.629  -1.851   0.394
   0.636  -1.856  -0.406
   1.552  -0.676  -0.159
   2.887  -1.126  -0.045
A1=A[A@H]2AA[A@@H]2A1
   1.858  -0.044   0.096
   1.070  -1.116   0.007
  -0.280  -0.670  -0.361
  -1.636  -0.783   0.236
  -1.670   0.685  -0.229
  -0.338   0.724   0.401
   0.996   1.203  -0.149
a1aaa2Aa3a[aH]aa3a2a1
   2.781  -1.164   0.001
   3.187   0.155  -0.004
   2.243   1.178   0.001
   0.878   0.866   0.001
  -0.323   1.724   0.001
  -1.500   0.845  -0.000
  -2.887   0.772  -0.000
  -3.221  -0.549  -0.001
  -2.056  -1.322  -0.000
  -1.009  -0.535  -0.000
   0.474  -0.481   0.001
   1.434  -1.485   0.001
a1aa2A=Aa3aaaa(a1)a23
   2.425  -1.001   0.001
   2.294   0.466   0.002
   1.125   1.045  -0.005
   0.500   2.376   0.001
  -0.779   2.192   0.001
  -1.130   0.890   0.000
  -2.395   0.124   0.000
  -2.353  -1.195   0.000
  -1.083  -1.954  -0.000
   0.041  -1.278  -0.000
   1.403  -1.839  -0.000
  -0.052   0.174   0.000
A1AAa2a(A1)aa1AAAAa21
   3.537  -0.092   0.389
   2.978  -1.267  -0.420
   1.556  -1.587   0.043
   0.730  -0.307   0.014
   1.325   0.903  -0.016
   2.795   1.188  -0.022
  -0.012   2.064  -0.044
  -1.334   0.959  -0.017
  -2.695   1.099  -0.021
  -3.495   0.015   0.001
  -2.987  -1.227   0.036
  -1.661  -1.452   0.041
  -0.733  -0.300   0.013
A1AA2AAAA(A1)A12AAAA1
  -2.088  -1.448   0.009
  -1.329  -1.211   1.306
  -0.469   0.047   1.268
  -1.330   1.304   1.214
  -2.074   1.460  -0.100
  -1.216   1.210  -1.329
  -0.360  -0.046  -1.212
  -1.219  -1.305  -1.231
   0.456   0.004   0.066
   1.595  -1.424   0.170
   3.181  -0.717  -0.428
   3.262   0.695   0.206
   1.594   1.432   0.063
A1AA[AH+]2AAA[A@H]2A1
  -2.185   0.654   0.170
  -2.155  -0.743  -0.271
  -0.886  -1.453   0.228
   0.282  -0.632  -0.251
   1.594  -1.191   0.105
   2.515   0.036  -0.132
   1.582   1.267   0.001
   0.223   0.666   0.372
  -0.972   1.400  -0.218
a1aaa2a(a1)aaa1aaaa21
  -3.286   0.128  -0.001
  -2.714   1.393  -0.001
  -1.344   1.545  -0.001
  -0.526   0.417  -0.001
  -1.109  -0.871  -0.001
  -2.496  -1.002   0.004
  -0.221  -2.038  -0.001
   1.105  -1.869  -0.001
   1.699  -0.624   0.000
   3.024  -0.287   0.000
   3.149   1.070   0.001
   1.788   1.616   0.001
   0.937   0.520   0.000
a1aaa2Aa3aaaaa3=Aa2a1
   3.585  -0.677   0.001
   3.585   0.720   0.001
   2.414   1.418   0.000
   1.197   0.731   0.000
  -0.086   1.433   0.000
  -1.215   0.687   0.000
  -2.460   1.329   0.000
  -3.570   0.637   0.000
  -3.540  -0.772   0.000
  -2.351  -1.425   0.000
  -1.146  -0.680   0.001
   0.007  -1.330   0.002
   1.183  -0.687  -0.006
   2.398  -1.382   0.000
a1aaa2[aH]a3aaaa3a2a1
   2.756   1.088  -0.001
   3.119  -0.249   0.000
   2.152  -1.233   0.000
   0.808  -0.882   0.001
  -0.366  -1.624   0.001
  -1.427  -0.749  -0.005
  -2.750  -0.705   0.001
  -3.163   0.558   0.000
  -2.045   1.369   0.000
  -0.949   0.515   0.001
   0.442   0.466   0.001
   1.424   1.448   0.000
a1aaa2aa3[aH]aaa3a2a1
   2.740  -1.110  -0.000
   3.111   0.227  -0.001
   2.155   1.218  -0.001
   0.800   0.874  -0.000
  -0.344   1.602  -0.000
  -1.385   0.794   0.001
  -2.753   0.761   0.001
  -3.138  -0.587  -0.004
  -2.067  -1.323   0.002
  -0.956  -0.505   0.001
   0.430  -0.482   0.001
   1.407  -1.465   0.001
a1aaa2A=AAa3aaaa3a2a1
  -2.661   1.557   0.328
  -3.310   0.332   0.145
  -2.569  -0.806  -0.156
  -1.174  -0.731  -0.277
  -0.452  -1.957  -0.640
   0.664  -2.392  -0.164
   1.389  -1.675   0.890
   1.741  -0.309   0.358
   2.930   0.206   0.225
   2.837   1.378  -0.300
   1.582   1.671  -0.518
   0.848   0.612  -0.082
  -0.538   0.489  -0.047
  -1.292   1.628   0.233
A1=A[A@H]2A=AA=A2A=A1
   1.979  -0.751   0.306
   0.877  -1.458  -0.015
  -0.271  -0.639  -0.546
  -1.580  -1.122   0.016
  -2.256  -0.028   0.282
  -1.491   1.122   0.075
  -0.247   0.836  -0.133
   0.966   1.394  -0.109
   2.019   0.650   0.122
A1AAA2=Aa3aaaaa3AA2A1
   3.576   0.669  -0.158
   3.458  -0.766  -0.622
   2.428  -1.462   0.285
   1.135  -0.676   0.188
   0.008  -1.322   0.138
  -1.184  -0.683   0.049
  -2.389  -1.381  -0.006
  -3.579  -0.682  -0.097
  -3.584   0.712  -0.139
  -2.414   1.414  -0.081
  -1.202   0.731   0.010
   0.085   1.435   0.069
   1.208   0.686   0.155
   2.454   1.326   0.212
A1AA[A@H]2AAA[A@H]2A1
   1.967  -0.524  -0.534
   1.892   0.984  -0.275
   0.429   1.418  -0.327
  -0.381   0.718   0.766
  -1.878   0.871   0.357
  -2.044  -0.211  -0.732
  -0.994  -1.202  -0.513
  -0.218  -0.810   0.667
   1.228  -1.245   0.593
a1aaa2AA3(AAAA3)Aa2a1
  -3.415   0.692   0.035
  -3.415  -0.692   0.030
  -2.223  -1.392   0.027
  -1.007  -0.704   0.017
   0.380  -1.204   0.006
   1.286   0.000  -0.008
   2.155  -0.002  -1.239
   3.481  -0.001  -0.773
   3.441   0.001   0.715
   2.167   0.001   1.141
   0.380   1.204   0.003
  -1.007   0.704   0.016
  -2.223   1.392   0.024
A1Aa2aaa3[aH]aaa3a2A1
  -3.059   0.948   0.007
  -2.765  -0.488  -0.005
  -1.380  -0.694  -0.003
  -0.668  -1.902   0.000
   0.710  -1.913   0.002
   1.418  -0.711   0.001
   2.762  -0.399   0.002
   2.923   0.959  -0.001
   1.722   1.561  -0.003
   0.711   0.502  -0.002
  -0.688   0.499   0.002
  -1.685   1.637   0.000
a1aaa2AAAa3aaaaa3a2a1
   2.809   1.606   0.539
   3.492   0.516   0.026
   2.803  -0.571  -0.475
   1.417  -0.573  -0.467
   0.697  -1.664  -0.946
   0.022  -2.550  -0.004
  -0.700  -1.750   1.079
  -1.450  -0.598   0.468
  -2.833  -0.607   0.373
  -3.447   0.459  -0.134
  -2.761   1.507  -0.545
  -1.446   1.551  -0.485
  -0.754   0.522  -0.002
   0.724   0.535   0.025
   1.428   1.623   0.546
A1A[A@@H]2AAA[A@H]2A1
  -2.119   0.003   0.010
  -1.360   1.139  -0.002
  -0.024   0.714   0.349
   1.222   1.393  -0.213
   2.433   0.009   0.038
   1.245  -1.412   0.084
  -0.034  -0.706  -0.296
  -1.362  -1.137   0.032
A1=AAa2aa3aaaaa3aa2A1
   3.552   0.745   0.001
   3.681  -0.628   0.001
   2.464  -1.456   0.000
   1.167  -0.751  -0.001
  -0.023  -1.466  -0.001
  -1.222  -0.740  -0.002
  -2.476  -1.377  -0.001
  -3.610  -0.628   0.005
  -3.559   0.773  -0.000
  -2.359   1.449  -0.000
  -1.157   0.723  -0.001
   0.027   1.339  -0.001
   1.162   0.664  -0.000
   2.358   1.352   0.000
a1aaa2[AH+]A[AH+]a2a1
   2.126  -0.692   0.041
   2.126   0.692   0.041
   0.934   1.388  -0.025
  -0.267   0.698  -0.093
  -1.597   1.057   0.185
  -2.393  -0.000  -0.213
  -1.597  -1.057   0.185
  -0.267  -0.698  -0.093
   0.934  -1.388  -0.025
A1A=Aa2a(A1)aa1aaaa21
   3.120  -0.253   0.001
   2.689   1.078   0.001
   1.441   1.397   0.001
   0.444   0.441  -0.001
   0.792  -0.903  -0.001
   2.214  -1.256   0.000
  -0.360  -1.651  -0.002
  -1.443  -0.764  -0.001
  -2.790  -0.659   0.004
  -3.142   0.638  -0.001
  -2.037   1.403  -0.001
  -0.924   0.528  -0.001
A1=Aa2a[aH][aH]a2=AA1
  -2.105  -0.717   0.001
  -0.941  -1.409   0.001
   0.291  -0.714  -0.000
   1.558  -1.088  -0.000
   2.345  -0.073  -0.002
   1.612   1.124   0.004
   0.278   0.756  -0.002
  -0.917   1.424  -0.002
  -2.117   0.694  -0.000
A1=AA2AAa3aaaa(A1)a23
  -2.401  -1.222  -0.000
  -2.361   0.157  -0.001
  -1.198   0.840  -0.001
  -0.921   2.288  -0.000
   0.616   2.412   0.001
   1.108   0.984   0.001
   2.360   0.395   0.002
   2.478  -1.001  -0.004
   1.371  -1.805   0.001
   0.103  -1.220   0.001
  -1.146  -1.997   0.001
  -0.005   0.174  -0.000
A1AAa2aa3AAA=Aa3aa2A1
  -3.635   0.628   0.429
  -3.631  -0.712  -0.318
  -2.381  -1.408   0.013
  -1.183  -0.692  -0.003
   0.013  -1.393   0.029
   1.220  -0.706   0.018
   2.420  -1.384   0.054
   3.585  -0.708   0.037
   3.606   0.701  -0.006
   2.446   1.403  -0.037
   1.212   0.702  -0.025
  -0.007   1.391  -0.055
  -1.188   0.702  -0.046
  -2.476   1.482  -0.086
a1aaa2a(a1)AAa1aaaa21
   3.282   0.107   0.049
   2.729   1.382   0.159
   1.355   1.541   0.126
   0.539   0.425  -0.019
   1.094  -0.856  -0.150
   2.465  -1.004  -0.105
   0.204  -2.052  -0.345
  -1.121  -1.916   0.401
  -1.710  -0.596   0.150
  -3.022  -0.256   0.083
  -3.133   1.084  -0.115
  -1.757   1.612  -0.196
  -0.930   0.523  -0.035
A1=Aa2aa3aaaaa3aa2AA1
  -3.524   0.707  -0.004
  -2.408   1.366   0.001
  -1.206   0.727   0.000
  -0.014   1.430   0.000
   1.199   0.731   0.000
   2.432   1.413   0.000
   3.591   0.702   0.000
   3.596  -0.691   0.000
   2.441  -1.408   0.000
   1.204  -0.733   0.000
  -0.006  -1.438   0.000
  -1.197  -0.738   0.000
  -2.501  -1.424   0.001
  -3.610  -0.649   0.001
A1Aa2[aH]a3aaaaa3a2A1
  -3.346   0.574   0.298
  -2.877  -0.842  -0.099
  -1.362  -0.781  -0.063
  -0.273  -1.614  -0.012
   0.884  -0.874   0.005
   2.239  -1.183   0.050
   3.119  -0.197   0.054
   2.734   1.075   0.016
   1.457   1.422  -0.026
   0.510   0.486  -0.032
  -0.951   0.499  -0.072
  -2.137   1.438  -0.121
A1A[A@H]2A=AA[A@H]2A1
  -1.900   0.158   0.620
  -0.904   1.289   0.329
   0.109   0.756  -0.702
   1.508   0.943  -0.142
   1.861  -0.155   0.440
   0.862  -1.155   0.377
  -0.044  -0.790  -0.681
  -1.493  -1.045  -0.243
A1A[A@H]2AAA[A@@H]2A1
  -2.120   0.005  -0.016
  -1.358   1.139   0.006
  -0.023   0.711  -0.345
   1.225   1.393   0.208
   2.435   0.006  -0.037
   1.245  -1.405  -0.085
  -0.038  -0.711   0.296
  -1.367  -1.138  -0.030
A1AA2=A(A1)Aa1aaaa1A2
   3.415  -0.008  -0.000
   2.611   1.071  -0.000
   1.192   0.646  -0.000
   1.143  -0.714  -0.000
   2.568  -1.207  -0.000
  -0.104  -1.377  -0.000
  -1.245  -0.660  -0.000
  -2.593  -1.039  -0.000
  -3.332   0.050  -0.000
  -2.477   1.165  -0.000
  -1.194   0.707  -0.000
   0.021   1.364   0.001
A1AAa2a(A1)aa1aaaaa21
  -3.451  -0.180  -0.004
  -3.112   1.122   0.001
  -1.652   1.513   0.001
  -0.651   0.437   0.001
  -1.093  -0.875   0.001
  -2.534  -1.157   0.001
  -0.011  -1.701   0.001
   1.152  -0.894   0.000
   2.523  -1.182  -0.000
   3.431  -0.164  -0.001
   3.009   1.160  -0.001
   1.668   1.469  -0.000
   0.721   0.448   0.000
A1=A[A@@H]2AA[A@H]2A1
   1.858  -0.035  -0.099
   1.081  -1.097  -0.005
  -0.279  -0.685   0.377
  -1.622  -0.780  -0.254
  -1.677   0.684   0.235
  -0.347   0.707  -0.395
   0.986   1.205   0.141
A1AA[A@@H]2AAA=AA2=A1
  -2.466   0.757  -0.003
  -2.295  -0.679   0.514
  -1.329  -1.412  -0.414
   0.012  -0.723  -0.494
   1.065  -1.405   0.381
   2.435  -0.806   0.055
   2.404   0.692   0.075
   1.301   1.414  -0.023
  -0.010   0.736  -0.146
  -1.117   1.426   0.054
a1aaa2[a+]a3AAAa3a2a1
  -2.826  -0.952  -0.000
  -3.150   0.397   0.001
  -2.161   1.355   0.001
  -0.819   0.963  -0.000
   0.354   1.644  -0.000
   1.350   0.794  -0.000
   3.127   0.718  -0.000
   3.346  -1.100  -0.001
   1.885  -1.575   0.004
   0.901  -0.494  -0.001
  -0.500  -0.401  -0.001
  -1.506  -1.354  -0.002
[AH2+]1AAA2(AA1)AAAA2
  -2.564   0.165   0.052
  -1.663   1.332  -0.062
  -0.405   1.070   0.771
   0.291  -0.187   0.251
  -0.673  -1.372   0.287
  -1.922  -1.033  -0.530
   0.777   0.030  -1.114
   2.106   0.265  -1.086
   2.573   0.207   0.352
   1.479  -0.481   1.078
A1AA[A@@H]2A[A@@H]2A1
  -1.354  -0.762  -0.461
  -1.578   0.616   0.122
  -0.370   1.518  -0.021
   0.921   0.821   0.383
   1.641   0.030  -0.720
   0.994  -0.695   0.453
  -0.254  -1.527   0.244
A1AA[A@H]2AAA[AH+]2A1
   2.174   0.743   0.277
   2.216  -0.715  -0.178
   0.923  -1.443   0.221
  -0.244  -0.666  -0.373
  -1.620  -1.234  -0.006
  -2.520   0.019   0.142
  -1.571   1.224  -0.090
  -0.265   0.630   0.251
   0.906   1.438  -0.240
a1aaa2Aa3aa[aH]a3a2a1
   2.774  -1.175  -0.000
   3.188   0.142  -0.000
   2.254   1.168  -0.001
   0.900   0.870  -0.000
  -0.316   1.721  -0.000
  -1.479   0.811   0.001
  -2.893   0.747   0.002
  -3.240  -0.523  -0.003
  -2.083  -1.310   0.002
  -1.007  -0.495   0.001
   0.476  -0.471  -0.000
   1.422  -1.487  -0.000
a1[aH]a2aaa3aaaa3a2a1
  -2.846  -0.953  -0.000
  -2.722   0.402   0.003
  -1.380   0.693   0.001
  -0.669   1.828   0.002
   0.632   1.836   0.001
   1.372   0.692  -0.003
   2.719   0.441  -0.006
   2.875  -0.899   0.005
   1.664  -1.470   0.003
   0.742  -0.530  -0.000
  -0.721  -0.540  -0.003
  -1.665  -1.504  -0.003
A1A[A@H]2A=A[A@@H]1A2
  -1.227  -0.779   0.518
  -1.220   0.766   0.508
   0.016   1.146  -0.323
   1.199   0.676   0.533
   1.210  -0.679   0.516
   0.025  -1.142  -0.342
  -0.004   0.011  -1.410
a1aaa2AAa3aaaaa3Aa2a1
  -3.267  -1.222   0.706
  -3.619   0.114   0.758
  -2.778   1.077   0.236
  -1.570   0.695  -0.349
  -0.715   1.665  -0.841
   0.442   1.900  -0.013
   1.438   0.771   0.024
   2.659   1.105   0.622
   3.671   0.185   0.755
   3.483  -1.103   0.288
   2.288  -1.436  -0.305
   1.258  -0.502  -0.446
   0.025  -1.018  -1.123
  -1.244  -0.634  -0.422
  -2.074  -1.600   0.114
A1AA2AAAa3aaaa(A1)a23
   2.168   1.779  -0.398
   0.732   2.239  -0.548
  -0.261   1.454   0.301
  -1.684   1.811  -0.137
  -2.665   0.814   0.487
  -2.465  -0.545  -0.188
  -1.013  -0.941  -0.106
  -0.683  -2.280  -0.269
   0.631  -2.694  -0.174
   1.629  -1.771   0.090
   1.300  -0.446   0.248
   2.333   0.605   0.557
  -0.022  -0.024   0.137
[AH2+]1AAA2(AAAA2)AA1
   2.596  -0.000   0.015
   1.816   1.213   0.346
   0.565   1.253  -0.536
  -0.269  -0.000  -0.286
  -1.512  -0.000  -1.189
  -2.633  -0.000  -0.235
  -2.140  -0.000   1.012
  -0.801  -0.000   1.065
   0.565  -1.253  -0.536
   1.817  -1.212   0.347
A1AAA2(AAA[AH2+]2)AA1
  -2.564   0.174  -0.002
  -1.669   1.334  -0.093
  -0.422   1.084   0.760
   0.278  -0.183   0.273
   0.817   0.017  -1.123
   2.147   0.226  -1.036
   2.561   0.197   0.372
   1.462  -0.447   1.073
  -0.685  -1.366   0.307
  -1.923  -1.037  -0.530
a1aaa2a(a1)AAA12AAAA1
  -3.198   0.549   0.029
  -2.366   1.671   0.065
  -0.978   1.501   0.055
  -0.444   0.236   0.009
  -1.269  -0.886  -0.027
  -2.653  -0.714  -0.016
  -0.497  -2.050  -0.062
   0.823  -1.785  -0.063
   0.966  -0.286  -0.016
   1.730   0.235  -1.237
   2.959   0.992  -0.688
   3.187   0.381   0.717
   1.742   0.154   1.233
A1AAa2aa3AAAAa3aa2AA1
  -3.907   0.021  -0.464
  -3.069   1.286  -0.554
  -2.147   1.361   0.535
  -0.971   0.689   0.368
   0.219   1.379   0.237
   1.413   0.688   0.066
   2.678   1.499  -0.061
   3.780   0.632  -0.491
   3.908  -0.676   0.173
   2.667  -1.500  -0.170
   1.413  -0.689   0.025
   0.215  -1.383   0.162
  -0.972  -0.698   0.332
  -2.150  -1.375   0.464
  -3.072  -1.240  -0.619
A1=AAa2aaa3aaaaa3a2A1
   2.862   1.520  -0.198
   3.440   0.294  -0.198
   2.749  -0.810   0.131
   1.392  -0.804   0.081
   0.714  -2.030   0.013
  -0.642  -2.084  -0.038
  -1.386  -0.891  -0.029
  -2.791  -0.908  -0.074
  -3.478   0.267  -0.058
  -2.810   1.489   0.006
  -1.451   1.543   0.056
  -0.707   0.350   0.043
   0.698   0.370   0.096
   1.415   1.692   0.171
A1=A[AH+]a2aaaaa2A=A1
  -2.511  -0.007   0.668
  -1.972  -1.243   0.401
  -0.981  -1.404  -0.562
   0.228  -0.669  -0.296
   1.400  -1.380  -0.111
   2.577  -0.715   0.195
   2.585   0.661   0.317
   1.424   1.384   0.115
   0.236   0.726  -0.210
  -0.889   1.463  -0.445
  -2.093   1.185  -0.074
A1[AH2+]Aa2[aH]aaa2A1
   2.131   0.627  -0.383
   2.096  -0.647   0.370
   0.976  -1.495  -0.107
  -0.287  -0.672  -0.045
  -1.575  -1.097  -0.062
  -2.396  -0.008   0.020
  -1.624   1.101   0.081
  -0.290   0.680   0.045
   0.967   1.512   0.085
A1=Aa2aaaa3AAA(A1)a23
  -2.456  -1.147  -0.000
  -1.340  -1.870  -0.001
  -0.029  -1.193  -0.000
   1.179  -1.893   0.000
   2.374  -1.192   0.000
   2.407   0.193  -0.000
   1.211   0.905  -0.000
   0.804   2.325  -0.000
  -0.685   2.302   0.000
  -1.083   1.016   0.000
  -2.403   0.363   0.001
   0.020   0.192  -0.000
A1=Aa2aa3AAAAa3aa2AA1
   3.604  -0.714  -0.029
   2.452  -1.432  -0.033
   1.180  -0.712  -0.014
  -0.040  -1.398  -0.036
  -1.224  -0.692  -0.019
  -2.403  -1.375  -0.046
  -3.574  -0.652   0.348
  -3.557   0.711  -0.356
  -2.374   1.409   0.046
  -1.210   0.705   0.024
  -0.009   1.392   0.047
   1.193   0.696   0.023
   2.400   1.366   0.038
   3.564   0.694   0.013
A1[AH2+]Aa2aa[aH]a2A1
   2.115  -0.657  -0.383
   2.094   0.615   0.373
   0.983   1.476  -0.103
  -0.289   0.667  -0.043
  -1.554   1.101  -0.064
  -2.367   0.070   0.016
  -1.617  -1.068   0.082
  -0.307  -0.680   0.043
   0.939  -1.528   0.081
A1AAA2(AA1)AAA[AH2+]2
  -2.630  -0.083  -0.015
  -1.732  -1.313  -0.161
  -0.490  -0.943  -0.976
   0.271   0.174  -0.264
  -0.623   1.402  -0.104
  -1.864   1.026   0.708
   0.727  -0.317   1.125
   2.195  -0.752   0.876
   2.661   0.298  -0.164
   1.483   0.506  -1.028
A1A=Aa2[a+]a[aH]a2A1
  -2.042  -0.681  -0.001
  -2.084   0.644  -0.001
  -0.969   1.366   0.000
   0.266   0.696   0.001
   1.563   1.090   0.002
   2.334   0.042  -0.004
   1.577  -1.093   0.001
   0.260  -0.709   0.001
  -0.904  -1.352   0.000
A1=AAa2[aH]a[a+]a2A1
   2.070  -0.672  -0.001
   2.105   0.633   0.001
   0.975   1.366   0.001
  -0.272   0.702   0.000
  -1.590   1.104  -0.001
  -2.345  -0.015  -0.002
  -1.571  -1.069   0.003
  -0.289  -0.689  -0.001
   0.913  -1.360  -0.001
A1AA[A@@]2(A1)AA=AA2
  -2.353  -0.490   0.081
  -2.098   0.779  -0.269
  -0.792   1.086  -0.329
   0.004  -0.134   0.029
  -1.040  -1.215   0.311
   0.918  -0.518  -0.998
   2.187   0.013  -0.652
   2.257   0.379   0.586
   0.915   0.101   1.243
A1A=Aa2aaa3aaaa3a2A1
  -2.629  -1.386   0.000
  -3.275  -0.133  -0.001
  -2.535   1.007  -0.001
  -1.076   0.885  -0.001
  -0.257   2.026   0.004
   1.103   1.901  -0.001
   1.699   0.635  -0.001
   2.983   0.223  -0.001
   3.057  -1.119  -0.000
   1.825  -1.648   0.001
   0.895  -0.513   0.000
  -0.500  -0.395   0.000
  -1.292  -1.487   0.001
a1aaa2a(a1)aa1aaaa21
  -3.282   0.136   0.000
  -2.761  -1.149   0.001
  -1.405  -1.366   0.001
  -0.506  -0.279   0.000
  -1.060   1.005   0.000
  -2.423   1.219   0.000
   0.343   2.091  -0.001
   1.625   0.884   0.000
   3.354   0.535   0.001
   3.246  -1.247   0.001
   1.876  -1.460  -0.005
   0.989  -0.367   0.001
a1aaa2aa[aH+]a2[a+]1
   2.046   0.694  -0.014
   2.111  -0.623   0.050
   1.005  -1.364   0.054
  -0.233  -0.711  -0.012
  -1.636  -1.144  -0.031
  -2.387  -0.018  -0.105
  -1.562   1.051   0.214
  -0.254   0.693  -0.078
   0.907   1.420  -0.080
A1AAAAAAAAAAAAAAAAA1
   3.719   0.286   0.391
   3.621  -0.982  -0.363
   2.795  -1.977   0.455
   1.722  -2.477  -0.347
   0.937  -3.483   0.295
  -0.437  -3.562  -0.373
  -1.315  -2.610   0.231
  -2.651  -2.649  -0.276
  -3.456  -1.491   0.318
  -2.993  -0.257  -0.235
  -3.591   0.902   0.350
  -3.047   2.157  -0.336
  -1.887   2.615   0.362
  -0.988   3.379  -0.445
   0.352   3.522   0.281
   1.340   2.733  -0.384
   2.451   2.377   0.441
   3.433   1.525  -0.365
A1=AA=A2AA=[A+]AA2A1
  -2.348   0.711  -0.174
  -2.339  -0.653  -0.151
  -1.192  -1.314   0.011
  -0.056  -0.673   0.155
   1.143  -1.346   0.291
   2.250  -0.753  -0.309
   2.388   0.582  -0.330
   1.290   1.345   0.365
  -0.007   0.692   0.159
  -1.133   1.405  -0.017
A1AAA2=AAAA[A@@H]2A1
   2.457   0.760  -0.069
   2.400  -0.730  -0.336
   1.304  -1.403   0.487
  -0.005  -0.681   0.212
  -1.027  -1.389  -0.175
  -2.366  -0.787  -0.491
  -2.524   0.520   0.292
  -1.346   1.432  -0.047
  -0.037   0.802   0.399
   1.144   1.477  -0.271
A1AAa2aa3AA=Aa3aa2A1
  -3.277   0.735  -0.350
  -3.307  -0.632   0.348
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a1aaa2AAa3aaaaa3a2a1
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a1aaa2Aa3aaaaa3Aa2a1
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A1AA2AAa3aaaaa3A2=A1
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a1aaa2AAAa3aaaa3a2a1
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a1aaa2Aa3aaaa3=Aa2a1
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A1AAa2aa3aaaaa3a2AA1
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a1aaa2Aa3aaaa3AAa2a1
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A1A[AH+]a2aaaaa2A=A1
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A1AA[A@@H]2AAAA=A2A1
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A1=A[A@H]2AA[A@H]2A1
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A1AAa2aaa3aaa(A1)a23
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A1AAa2aa3AAAAa3aa2A1
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A1A[A@H]2AAA[A@H]2A1
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   0.020   0.773   0.621
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a1aaa2aaa3AAA=a3a2a1
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A1=AAa2aa3AAAa3aa2A1
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a1aa2A=a3aaaaa3Aa2a1
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A1A[A@H]2AA[A@@H]1A2
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A1A[A@@H]2AA[A@H]1A2
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A1A[AH+]2AA[AH+]1AA2
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  -0.765  -0.282   1.356
   0.765  -0.282   1.356
A1AA2=AAa3aaaaa3A2A1
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A1A[AH+]2AAA[A@H]2A1
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a1aaa2[a+]aa[a+]a2a1
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A1A[A@@H]2A[A@@H]2A1
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A1AA=A2AA[AH2+]AA2A1
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A1A=Aa2aa3AAAa3aa2A1
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A1AAa2a(A1)aa1AAAa21
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A1AAa2aaaaa2A[AH2+]1
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A1AA2AAAA(A1)[AH2+]2
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A1=Aa2aa3aaaaa3a2AA1
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A1A=Aa2aa3aaaa3aa2A1
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A1AAa2aaa3aaaaa3a2A1
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A1AA2=Aa3aaaaa3AA2A1
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A1AA2AAa3aaaa(A1)a23
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a1aa2AAa3aaaa(a1)a23
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[AH2+]1AAa2aaaaa2AA1
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A1AAA2Aa3aaaa3A=A2A1
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A1AA[A@H]2AA=AA=A2A1
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a1aaa2aa3aaaaa3aa2a1
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A1AA[A+]2=A(AA1)AAA2
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a1aaa2a(a1)aa1AAAa21
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A1AAa2aa3aaaaa3aa2A1
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   1.215   0.741   0.025
   2.457   1.391   0.041
   3.592   0.634   0.012
   3.545  -0.689  -0.030
   2.417  -1.361  -0.035
   1.190  -0.675  -0.015
   0.022  -1.315  -0.039
  -1.136  -0.678  -0.024
  -2.383  -1.526  -0.066
A1AA[A@H]2AAA=AA2=A1
  -2.466  -0.757  -0.003
  -2.295   0.679   0.514
  -1.329   1.412  -0.413
   0.012   0.723  -0.493
   1.066   1.405   0.381
   2.435   0.806   0.054
   2.404  -0.692   0.075
   1.301  -1.414  -0.023
  -0.010  -0.736  -0.145
  -1.117  -1.426   0.054
a1aa2AAAa3aaa(a1)a23
   2.331   1.222   0.030
   1.130   1.923  -0.042
  -0.072   1.256  -0.082
  -1.322   1.768  -0.152
  -2.376   0.979   0.417
  -2.422  -0.446  -0.154
  -1.064  -1.008  -0.076
  -0.598  -2.266  -0.024
   0.783  -2.260   0.040
   1.200  -0.861   0.025
   2.408  -0.163   0.065
   0.006  -0.139  -0.047
A1=A[AH+]a2aaaaa2AA1
   2.768   0.019   0.000
   2.187  -1.233  -0.001
   0.815  -1.686  -0.001
  -0.260  -0.689   0.000
  -1.459  -1.382   0.001
  -2.656  -0.687   0.001
  -2.659   0.695  -0.004
  -1.464   1.393   0.002
  -0.262   0.705   0.001
   0.836   1.580   0.000
   2.150   1.280   0.000
a1aaa2[a+]a[aH+]a2a1
   2.127   0.676  -0.014
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   0.912  -1.397   0.057
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  -1.577   1.075   0.211
  -0.269   0.715  -0.084
   0.948   1.386  -0.084
A1A=A2AAa3aaaaa3A2A1
  -3.037   1.061  -0.000
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  -1.696  -0.671   0.000
  -1.012  -1.977   0.001
   0.334  -2.022   0.000
   1.088  -0.844  -0.000
   2.475  -0.918  -0.001
   3.231   0.237  -0.001
   2.608   1.479  -0.001
   1.223   1.560   0.004
   0.461   0.401  -0.000
  -0.936   0.489  -0.001
  -1.777   1.542  -0.001
A1[AH2+]Aa2aaaaa2A1
   2.400   0.644   0.393
   2.377  -0.618  -0.375
   1.261  -1.461   0.089
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  -1.243  -1.371   0.059
  -2.377  -0.676   0.019
  -2.354   0.646  -0.042
  -1.214   1.321  -0.073
  -0.046   0.693  -0.033
   1.223   1.501  -0.074
A1AA[A@@H]2AAAAA2A1
   2.438   0.749  -0.284
   2.473  -0.697   0.203
   1.215  -1.417  -0.288
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  -1.269  -1.414  -0.243
  -2.505  -0.658   0.254
  -2.366   0.750  -0.133
  -1.157   1.320  -0.200
  -0.015   0.671   0.110
   1.204   1.467   0.229
A1A=AA2=A(A1)AA=AA2
  -2.410   0.575  -0.067
  -2.346  -0.783  -0.069
  -1.159  -1.421  -0.000
   0.035  -0.674   0.075
  -0.038   0.703   0.077
  -1.293   1.322   0.005
   1.210   1.539   0.159
   2.417   0.702  -0.166
   2.356  -0.650  -0.159
   1.224  -1.310   0.144
A1=AAA2=A(A1)AA=AA2
   2.377  -0.789  -0.080
   2.385   0.558  -0.073
   1.266   1.273   0.006
   0.066   0.678   0.082
  -0.048  -0.666   0.081
   1.132  -1.461  -0.001
  -1.254  -1.280   0.156
  -2.371  -0.605  -0.165
  -2.392   0.750  -0.177
  -1.165   1.546   0.170
A1AA[A@@H]2AAA=A2A1
  -2.113   0.649   0.442
  -2.090  -0.807  -0.020
  -0.740  -1.461   0.288
   0.340  -0.761  -0.542
   1.751  -1.135  -0.070
   2.337   0.167   0.301
   1.354   1.150   0.178
   0.239   0.725  -0.232
  -1.075   1.469  -0.342
a1aaa2[aH]aa[a+]2a1
  -2.094  -0.683   0.004
  -2.119   0.710  -0.001
  -0.918   1.393  -0.001
   0.274   0.671  -0.000
   1.591   1.086   0.001
   2.373  -0.054   0.001
   1.534  -1.117  -0.000
   0.258  -0.666  -0.001
  -0.899  -1.336  -0.002
a1aaa2[aH]a[a+]a2a1
   2.101   0.717  -0.000
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   0.951  -1.390  -0.002
  -0.267  -0.719   0.005
  -1.583  -1.125  -0.001
  -2.361   0.041  -0.000
  -1.590   1.071  -0.000
  -0.293   0.686  -0.001
   0.916   1.393  -0.000
A1A[AH2+]AA[AH2+]A1
   1.134  -1.177   0.153
   1.628   0.166  -0.137
   0.741   1.211   0.439
  -0.387   1.423  -0.442
  -1.609   0.591  -0.014
  -1.238  -0.791   0.447
  -0.266  -1.420  -0.447
A1AA2=AA[AH2+]AA2A1
  -2.531   0.740  -0.062
  -2.021  -0.974  -0.089
  -0.274  -0.710   0.037
   0.686  -1.571   0.072
   2.063  -1.068   0.199
   2.161   0.250  -0.472
   1.255   1.231   0.175
  -0.123   0.674   0.088
  -1.218   1.431   0.050
A1A[AH+]a2aaaaa2AA1
   2.800  -0.003  -0.259
   2.001   1.261  -0.475
   0.935   1.399   0.577
  -0.271   0.693   0.279
  -1.425   1.409  -0.001
  -2.609   0.723  -0.285
  -2.620  -0.676  -0.289
  -1.463  -1.375  -0.012
  -0.299  -0.692   0.284
   0.960  -1.461   0.642
   1.992  -1.277  -0.466
A1=Aa2aaaaa2A[AH+]1
  -2.395   0.744   0.027
  -1.253   1.414  -0.166
   0.029   0.689  -0.080
   1.235   1.379   0.034
   2.419   0.674   0.121
   2.409  -0.709   0.095
   1.215  -1.400  -0.020
   0.028  -0.709  -0.114
  -1.284  -1.440  -0.255
  -2.400  -0.638   0.359
A1AAA2=[A+](A1)AAA2
  -2.165  -0.633   0.382
  -2.154   0.703  -0.369
  -0.940   1.515   0.089
   0.292   0.627   0.035
   0.246  -0.661  -0.043
  -0.978  -1.474  -0.099
   1.606  -1.223  -0.067
   2.522   0.013   0.006
   1.568   1.130   0.063
A1AAa2aa3aaaa3aa2A1
   3.335   0.645  -0.393
   3.260  -0.692   0.357
   2.069  -1.367  -0.046
   0.899  -0.671  -0.015
  -0.256  -1.401  -0.042
  -1.505  -0.763  -0.025
  -2.777  -1.081  -0.042
  -3.441  -0.064  -0.011
  -2.823   0.981   0.027
  -1.541   0.721   0.025
  -0.279   1.435   0.057
   0.887   0.734   0.037
   2.174   1.524   0.077
A1AAa2aa3AAAa3aa2A1
   3.354   0.664   0.352
   3.277  -0.676  -0.391
   2.097  -1.359   0.034
   0.927  -0.666   0.029
  -0.265  -1.382   0.081
  -1.478  -0.717   0.086
  -2.763  -1.176   0.132
  -3.581  -0.072  -0.299
  -2.807   1.088   0.053
  -1.504   0.675   0.041
  -0.317   1.383  -0.012
   0.898   0.716  -0.020
   2.168   1.526  -0.088
A1AAa2aa3aaaaa3a2A1
  -2.984  -1.197   0.414
  -3.454  -0.066  -0.324
  -2.791   1.160   0.022
  -1.316   0.904   0.014
   0.010   2.078   0.037
   1.372   0.941   0.008
   2.686   1.059   0.008
   3.451  -0.014  -0.017
   2.933  -1.229  -0.043
   1.627  -1.439  -0.041
   0.746  -0.322  -0.019
  -0.715  -0.305  -0.015
  -1.569  -1.570  -0.040
A1A=Aa2aaaaa2[AH+]1
   2.284   0.719   0.458
   2.393  -0.728   0.059
   1.284  -1.416  -0.210
  -0.006  -0.694  -0.106
  -1.204  -1.386   0.027
  -2.393  -0.680   0.129
  -2.380   0.707   0.093
  -1.187   1.394  -0.034
   0.003   0.702  -0.139
   1.210   1.386  -0.281
A1AAA2=AAAA[A@H]2A1
   2.442  -0.782   0.041
   2.417   0.702  -0.330
   1.310   1.407   0.460
  -0.000   0.684   0.197
  -1.025   1.388  -0.185
  -2.369   0.786  -0.482
  -2.522  -0.520   0.328
  -1.348  -1.431  -0.032
  -0.031  -0.804   0.393
   1.126  -1.430  -0.391
A1Aa2aaa3aaaaa3a2A1
  -3.207  -1.021   0.002
  -2.992   0.303  -0.001
  -1.677   0.632  -0.001
  -1.064   1.898   0.000
   0.287   2.027   0.000
   1.107   0.885   0.000
   2.504   0.993   0.001
   3.277  -0.158   0.000
   2.669  -1.427  -0.001
   1.318  -1.550  -0.000
   0.504  -0.401   0.000
  -0.891  -0.499  -0.000
  -1.840  -1.676  -0.000
a1aa[a+]2aa[aH]a2a1
   2.123  -0.688   0.001
   2.038   0.700  -0.000
   0.870   1.296  -0.001
  -0.247   0.652  -0.001
  -1.518   1.106   0.003
  -2.345   0.103  -0.001
  -1.584  -1.076  -0.000
  -0.270  -0.683  -0.000
   0.932  -1.409   0.001
A1=AAa2aaaaa2[AH+]1
  -2.359   0.662  -0.145
  -2.455  -0.679  -0.155
  -1.229  -1.467   0.140
   0.042  -0.708   0.075
   1.265  -1.374   0.014
   2.434  -0.648  -0.068
   2.381   0.746  -0.076
   1.160   1.406  -0.009
  -0.019   0.689   0.071
  -1.221   1.377   0.153
A1AAA2(AA1)AA=AA=A2
   2.873   0.195  -0.110
   2.166  -0.313   1.149
   0.978  -1.188   0.748
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   0.703   0.140  -1.347
   1.891   1.016  -0.948
  -0.474   0.822   0.713
  -1.778   1.198   0.737
  -2.725   0.497   0.028
  -2.451  -0.778  -0.413
  -1.171  -1.231  -0.476
A1AA[A@]2(A1)AA=AA2
  -2.192   0.554  -0.603
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  -0.732   0.868  -0.867
   0.911  -0.941  -0.622
   2.196  -0.350  -0.529
   2.268   0.555   0.391
   0.906   0.667   1.057
a1aaa2aa3aaaa3aa2a1
   3.292  -0.852  -0.002
   3.305   0.473  -0.004
   2.215   1.200  -0.003
   1.002   0.615   0.001
  -0.165   1.371   0.002
  -1.422   0.743   0.005
  -2.646   1.313   0.006
  -3.746   0.615  -0.008
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  -1.440  -0.679   0.002
  -0.307  -1.438   0.006
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   2.153  -1.532   0.001
A1AAa2[a+]a[aH]a2A1
   2.078   0.693  -0.001
   2.127  -0.650  -0.000
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  -0.292  -0.688   0.001
  -1.585  -1.090   0.002
  -2.357  -0.041  -0.004
  -1.591   1.089   0.001
  -0.288   0.701   0.001
   0.915   1.369  -0.000
a1aaa2Aa3aaaa3Aa2a1
  -3.409   0.915  -0.001
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  -1.064  -0.604   0.005
   0.164  -1.409  -0.001
   1.501  -0.753  -0.001
   2.763  -1.362  -0.001
   3.880  -0.602   0.000
   3.267   1.019   0.000
   1.532   0.645   0.000
   0.327   1.459   0.000
  -0.994   0.805   0.000
  -2.167   1.560   0.000
[AH2+]1AAa2aaaaa2A1
   2.404   0.610   0.366
   2.414  -0.657  -0.389
   1.232  -1.509   0.074
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  -1.251  -1.359   0.074
  -2.436  -0.650   0.044
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  -1.199   1.394  -0.063
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   1.286   1.451  -0.084
A1AA[A+]2=A(AAA2)A1
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   0.208   0.712   0.023
   1.379   1.444   0.041
   2.520   0.523   0.007
   1.854  -0.862  -0.038
  -1.392   1.481   0.067
a1[aH]a2aaa[a+]a2a1
   2.339  -0.071   0.001
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   0.281   0.719  -0.005
  -0.925   1.435   0.001
  -2.118   0.710   0.001
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   0.252  -0.683   0.000
   1.542  -1.101   0.000
A1=Aa2aa3AAAa3a2AA1
  -3.217  -0.134   0.049
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   0.345  -2.027   0.003
   1.618  -0.787  -0.059
   3.112  -0.603  -0.099
   3.331   0.875   0.299
   1.995   1.514  -0.128
   0.962   0.384  -0.072
  -0.508   0.324  -0.032
  -1.433   1.415  -0.034
  -2.753   1.151   0.007
A1AA[A@H]2AAAA=A2A1
   2.369  -0.558  -0.075
   2.210   0.738  -0.389
   1.045   1.415  -0.178
  -0.072   0.717   0.548
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  -0.989  -1.403  -0.154
   0.053  -0.758   0.226
   1.315  -1.332   0.268
A1AA2AA3AA1AA(A2)A3
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   0.124   0.589   1.593
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   0.121  -0.608  -1.603
   1.005   0.539  -1.151
   0.210   1.737  -0.649
   1.967   0.088  -0.048
A1Aa2aa3aaaaa3aa2A1
   3.673  -0.022  -0.001
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  -3.305   0.722   0.000
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   0.262   1.341   0.000
   1.403   0.705   0.000
   2.837   1.183  -0.001
A1AAAAAa2aaaa2AAAA1
   2.784  -0.782  -0.663
   2.926   0.411   0.284
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   1.570   2.460  -0.171
   0.361   1.605  -0.557
  -0.378   1.167   0.708
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  -4.118   0.682   0.132
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A1AAa2[aH]a[a+]a2A1
   2.122   0.675   0.380
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   0.955  -1.519   0.089
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  -1.592  -1.095   0.071
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   0.933   1.521  -0.092
A1AA[A@H]2A[A@H]2A1
   1.335   0.616   0.492
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  -1.613   0.106   0.722
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   0.412   1.471  -0.261
A1AAAa2aaa[a+]a2AA1
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  -2.067   1.077   0.754
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   0.409   0.784   0.190
   1.598   1.442  -0.231
   2.769   0.726  -0.427
   2.759  -0.644  -0.205
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   0.498  -0.566   0.395
  -0.625  -1.459   0.861
  -1.667  -1.693  -0.214
a1aaa2aaa3aaaa3a2a1
   2.672  -1.440   0.000
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   2.492   0.958   0.001
   1.102   0.850   0.000
   0.236   2.036   0.000
  -1.063   1.903   0.000
  -1.689   0.657  -0.001
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   1.301  -1.570  -0.001
A1AAa2aaa3aaaa3a2A1
   2.737  -1.328  -0.394
   3.254  -0.126   0.406
   2.493   1.117  -0.050
   1.009   0.870  -0.027
   0.147   1.994  -0.052
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a1[aH]a2aa[aH]a2a1
  -2.081   0.046  -0.001
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   1.336  -1.106  -0.001
   2.100  -0.047  -0.001
   1.295   1.100  -0.000
  -0.013   0.696  -0.000
  -1.299   1.089  -0.000
A1AA[A@@H]2AAAA2A1
  -2.262  -0.629  -0.179
  -2.124   0.848   0.144
  -0.775   1.415  -0.297
   0.332   0.685   0.469
   1.659   1.078  -0.002
   2.383  -0.023  -0.299
   1.567  -1.244   0.083
   0.188  -0.750   0.153
  -0.967  -1.379  -0.070
a1aaa2A[AH2+]Aa2a1
  -2.154  -0.690  -0.076
  -2.153   0.693  -0.075
  -0.958   1.384  -0.001
   0.234   0.692   0.074
   1.675   1.154   0.165
   2.413   0.002  -0.324
   1.673  -1.158   0.164
   0.233  -0.694   0.073
  -0.960  -1.383  -0.001
a1aa2aaa3aaaa3a2a1
   3.328   0.681  -0.001
   2.767  -0.495  -0.000
   1.429  -0.659  -0.000
   0.672  -1.857   0.001
  -0.677  -1.852   0.001
  -1.430  -0.649   0.001
  -2.771  -0.501  -0.004
  -3.352   0.677   0.001
  -1.953   1.789   0.001
  -0.680   0.548   0.001
   0.688   0.544   0.001
   1.975   1.768  -0.000
a1aaa2aa3aaaa3a2a1
  -2.711  -1.151  -0.000
  -3.218   0.138  -0.000
  -2.342   1.208  -0.001
  -0.986   0.974  -0.000
   0.448   2.022  -0.000
   1.683   0.743  -0.000
   2.957   0.477   0.001
   3.122  -0.863   0.002
   1.895  -1.437  -0.004
   0.954  -0.411   0.001
  -0.443  -0.316   0.001
  -1.356  -1.383   0.001
A1=Aa2aaaaa2A[A-]1
  -2.175  -1.186  -0.003
  -0.937  -1.484   0.174
   0.136  -0.651   0.095
   1.434  -1.168   0.045
   2.512  -0.313  -0.046
   2.324   1.058  -0.088
   1.042   1.583  -0.035
  -0.033   0.738   0.060
  -1.688   1.356   0.157
  -2.614   0.065  -0.363
A1AA[AH+]2AAAAA2A1
   2.505  -0.702  -0.245
   2.457   0.726   0.307
   1.200   1.417  -0.221
   0.001   0.691   0.232
  -1.200   1.417  -0.220
  -2.457   0.726   0.308
  -2.505  -0.702  -0.245
  -1.241  -1.441   0.195
  -0.000  -0.694  -0.305
   1.240  -1.441   0.196
A1AAa2aa3aaaa3a2A1
  -2.643  -1.510   0.422
  -3.291  -0.386  -0.392
  -2.645   0.948   0.012
  -1.159   0.772   0.009
   0.091   2.026   0.038
   1.528   0.959   0.013
   2.857   1.024   0.020
   3.609  -0.055  -0.010
   2.385  -1.355  -0.038
   0.935  -0.305  -0.015
  -0.467  -0.393  -0.017
  -1.205  -1.730  -0.045
A1AAA2(AA1)AAA=AA2
  -2.858   0.837  -0.060
  -1.654   1.737   0.194
  -0.249   1.195  -0.818
   0.086  -0.487  -0.224
  -1.427  -1.479  -0.371
  -2.654  -0.535   0.574
   1.198  -1.116  -1.067
   2.391  -0.158  -1.095
   2.731   0.286   0.298
   1.906   0.161   1.336
   0.533  -0.439   1.236
A1AAAA2(AAA1)AAAA2
  -2.353   0.347  -0.993
  -2.118  -1.140  -0.779
  -1.447  -1.466   0.546
   0.065  -1.583   0.373
   0.743  -0.219   0.379
   0.024   0.776   1.282
  -0.847   1.722   0.461
  -2.258   1.161   0.289
   0.873   0.295  -0.989
   2.192   0.432  -1.228
   2.941   0.049  -0.187
   2.180  -0.370   0.843
A1[AH2+]Aa2aaaa2A1
  -2.117   0.974  -0.361
  -2.203  -0.285   0.417
  -1.228  -1.278  -0.093
   0.162  -0.651  -0.048
   1.346  -1.387  -0.057
   2.542  -0.744  -0.005
   2.036   0.969   0.069
   0.287   0.703   0.025
  -0.825   1.701   0.052
A1AAA2AAA[A@@H]2A1
  -2.186   0.752  -0.168
  -2.132  -0.686   0.082
  -0.972  -1.370   0.085
   0.192  -0.715  -0.081
   1.548  -1.246   0.081
   2.525  -0.058  -0.067
   1.622   1.175   0.211
   0.285   0.721  -0.420
  -0.885   1.427   0.276
A1AAA2=A(A1)AAA=A2
  -2.406  -0.676   0.400
  -2.415   0.678  -0.321
  -1.177   1.387   0.032
   0.023   0.692   0.012
   0.042  -0.694  -0.053
  -1.225  -1.501  -0.114
   1.273  -1.340  -0.061
   2.385  -0.612  -0.009
   2.330   0.710   0.050
   1.174   1.358   0.060
A1AA2=AAA[A@@H]2A1
  -2.200  -0.127  -0.192
  -1.444   1.175   0.155
   0.025   0.818   0.119
   1.213   1.118  -0.189
   2.077   0.023  -0.184
   1.402  -1.120   0.093
   0.039  -0.658   0.521
  -1.114  -1.227  -0.320
A1=[A+]a2aaaaa2AA1
  -2.231   0.715  -0.001
  -1.154   1.264  -0.001
  -0.078   0.694  -0.001
   1.120   1.426   0.000
   2.328   0.764   0.001
   2.384  -0.631   0.001
   1.236  -1.373  -0.000
  -0.012  -0.722  -0.001
  -1.222  -1.447  -0.002
  -2.370  -0.686   0.004
a1aa2AAa3aaaa3a2a1
  -2.964  -1.346   0.127
  -3.025   0.428  -0.045
  -1.344   0.758  -0.123
  -0.607   2.043  -0.306
   0.772   1.984   0.354
   1.428   0.692   0.121
   2.758   0.453   0.022
   2.977  -0.884  -0.131
   1.642  -1.527  -0.145
   0.741  -0.495  -0.011
  -0.741  -0.496   0.005
  -1.639  -1.610   0.132
A1A=Aa2aaa[a+]a2A1
   2.359  -0.765   0.357
   2.339   0.704   0.019
   1.220   1.340  -0.162
   0.024   0.711  -0.075
  -1.169   1.435   0.040
  -2.356   0.728   0.108
  -2.334  -0.655   0.064
  -1.200  -1.399  -0.043
  -0.037  -0.697  -0.107
   1.156  -1.401  -0.202
A1A=AA2AA[A@@H]2A1
   1.838   0.800   0.049
   1.825  -0.691  -0.058
   0.710  -1.440  -0.026
  -0.497  -0.713   0.089
  -1.795  -0.810  -0.129
  -1.974   0.683  -0.147
  -0.603   0.710   0.497
   0.496   1.459  -0.274
A1AAa2[a+]aaaa2AA1
  -2.950  -0.022  -0.115
  -2.055  -1.104  -0.724
  -0.945  -1.375   0.258
   0.329  -0.650   0.125
   1.482  -1.391   0.207
   2.646  -0.700   0.068
   2.705   0.676  -0.146
   1.522   1.405  -0.219
   0.301   0.725  -0.074
  -0.973   1.530  -0.126
  -2.063   0.902   0.744
A1AAA2AA[A+]=A2AA1
  -2.619  -0.016  -0.406
  -1.934   0.920   0.601
  -0.651   1.513   0.146
   0.521   0.743  -0.024
   1.874   1.189  -0.398
   2.745  -0.056  -0.144
   1.776  -1.097   0.213
   0.576  -0.620   0.225
  -0.683  -1.423   0.478
  -1.603  -1.155  -0.691
a1aaa2AA[A+]=Aa2a1
  -2.391  -0.745   0.120
  -2.424   0.638   0.101
  -1.253   1.366  -0.024
  -0.047   0.710  -0.124
   1.245   1.471  -0.277
   2.371   0.714   0.425
   2.387  -0.693   0.038
   1.304  -1.358  -0.185
  -0.005  -0.686  -0.097
  -1.187  -1.414   0.027
A1AAA2=A(A1)A=AAA2
   2.415  -0.682   0.299
   2.346   0.681  -0.404
   1.195   1.427   0.116
  -0.003   0.692   0.057
  -0.016  -0.691  -0.011
   1.174  -1.406  -0.021
  -1.183  -1.348  -0.052
  -2.328  -0.701  -0.048
  -2.373   0.658   0.006
  -1.231   1.374   0.060
A1=AAa2[a+]aaaa2A1
  -2.472  -0.640   0.004
  -2.360   0.735  -0.001
  -1.173   1.355  -0.000
   0.025   0.678  -0.001
   1.171   1.424  -0.000
   2.337   0.720   0.001
   2.415  -0.677   0.001
   1.260  -1.413  -0.000
   0.039  -0.728  -0.001
  -1.242  -1.451  -0.002
A1A[A@H]2A[A@H]2A1
  -1.577  -0.000  -0.037
  -0.697   1.172   0.202
   0.660   0.771  -0.414
   1.651  -0.000   0.461
   0.660  -0.771  -0.414
  -0.698  -1.172   0.202
A1A=Aa2[aH]aaa2=A1
   2.071   0.693  -0.001
   2.095  -0.718  -0.001
   0.912  -1.397   0.000
  -0.259  -0.690   0.000
  -1.606  -1.081   0.001
  -2.343   0.073  -0.003
  -1.524   1.103   0.002
  -0.248   0.679   0.001
   0.899   1.342   0.000
a1aaa2aa3AAAa3a2a1
  -2.757  -1.137  -0.016
  -3.158   0.191  -0.054
  -2.232   1.197  -0.050
  -0.871   0.885  -0.006
   0.355   1.682   0.011
   1.388   0.818   0.057
   2.905   0.814   0.097
   3.292  -0.628  -0.298
   2.042  -1.425   0.127
   0.921  -0.468   0.072
  -0.462  -0.458   0.033
  -1.419  -1.466   0.027
A1=AA=A2A=AAA=A2A1
   2.376   0.618   0.001
   2.376  -0.742  -0.004
   1.172  -1.441   0.002
  -0.024  -0.708   0.001
  -1.274  -1.357   0.001
  -2.416  -0.627  -0.000
  -2.361   0.782  -0.001
  -1.129   1.442  -0.000
   0.041   0.709  -0.000
   1.241   1.321   0.001
A1A=Aa2[a+]aaaa2A1
  -2.383   0.631   0.002
  -2.285  -0.723   0.001
  -1.152  -1.358  -0.000
   0.033  -0.702  -0.000
   1.194  -1.360  -0.000
   2.327  -0.688  -0.001
   2.325   0.713   0.000
   1.178   1.379   0.001
   0.033   0.710   0.001
  -1.270   1.400  -0.004
A1AAa2aaaaa2[AH+]1
   2.340   0.677  -0.409
   2.441  -0.650   0.353
   1.250  -1.519  -0.058
  -0.013  -0.694  -0.023
  -1.227  -1.364  -0.057
  -2.415  -0.663  -0.034
  -2.394   0.718   0.023
  -1.187   1.385   0.061
   0.012   0.681   0.043
   1.190   1.425   0.102
A1Aa2aaa3AAAa3a2A1
   3.031   0.979  -0.000
   2.786  -0.471  -0.002
   1.415  -0.702  -0.000
   0.703  -1.907  -0.001
  -0.674  -1.903  -0.000
  -1.390  -0.699   0.002
  -2.775  -0.493   0.004
  -3.069   0.942  -0.005
  -1.695   1.632   0.000
  -0.699   0.494  -0.002
   0.704   0.505   0.002
   1.661   1.621   0.002
A1AA[AH2+]A[AH2+]1
   1.248   0.687   0.241
  -0.000   1.426  -0.252
  -1.247   0.687   0.241
  -1.199  -0.706  -0.253
  -0.000  -1.388   0.277
   1.199  -0.706  -0.253
a1aa2aa3aaaa3aa2a1
   3.559   0.413  -0.001
   2.472   1.145   0.004
   1.228   0.607  -0.001
  -0.000   1.289  -0.002
  -1.228   0.607  -0.001
  -2.472   1.145  -0.001
  -3.559   0.413   0.000
  -2.902  -1.249   0.001
  -1.182  -0.809   0.000
  -0.000  -1.504   0.000
   1.182  -0.809   0.000
   2.902  -1.249   0.000
A1=AAa2aa[aH]a2=A1
   2.076  -0.706  -0.001
   2.106   0.683  -0.001
   0.891   1.381   0.000
  -0.263   0.682   0.001
  -1.585   1.088   0.002
  -2.354   0.002  -0.004
  -1.537  -1.110   0.001
  -0.241  -0.678   0.001
   0.903  -1.343   0.000
A1AAA2=A(A1)AA=AA2
   2.426  -0.703  -0.382
   2.453   0.626   0.384
   1.272   1.472  -0.086
  -0.006   0.678  -0.031
  -0.035  -0.665   0.031
   1.216  -1.504   0.089
  -1.231  -1.322   0.054
  -2.414  -0.666   0.029
  -2.449   0.683  -0.024
  -1.231   1.397  -0.062
A1A=Aa2a[a+]aaa2A1
  -2.427   0.648   0.359
  -2.313  -0.817   0.023
  -1.160  -1.387  -0.157
   0.003  -0.685  -0.075
   1.243  -1.327   0.033
   2.431  -0.653   0.098
   2.352   0.713   0.063
   1.162   1.424  -0.040
  -0.029   0.722  -0.107
  -1.263   1.359  -0.196
a1aaa2Aa3aaaa3a2a1
   2.801  -1.056   0.002
   3.204   0.268   0.001
   2.261   1.282  -0.000
   0.919   0.969  -0.000
  -0.330   1.817  -0.001
  -1.467   0.850  -0.000
  -3.228   0.620  -0.000
  -3.212  -1.168   0.001
  -1.922  -1.417   0.001
  -0.993  -0.430  -0.000
   0.504  -0.357   0.001
   1.459  -1.375  -0.004
A1AAAA2(AA1)AAA=A2
   2.216   0.781   0.644
   2.463  -0.568   0.012
   1.363  -1.528   0.440
   0.168  -1.525  -0.422
  -0.510  -0.131  -0.372
   0.346   0.876  -1.058
   1.422   1.668  -0.333
  -0.748   0.234   1.012
  -2.076   0.355   1.189
  -2.781   0.071  -0.077
  -1.864  -0.231  -1.031
A1A2AA3AA1AA(A2)A3
  -0.769   1.026   1.215
  -1.501   0.277   0.100
  -0.985   0.753  -1.259
   0.517   0.476  -1.359
   1.249   1.225  -0.244
   0.732   0.750   1.115
   0.985  -0.753   1.259
   0.253  -1.502   0.144
  -1.249  -1.225   0.244
   0.769  -1.026  -1.215
A1Aa2aaa3aaaa3a2A1
  -2.923  -1.009  -0.280
  -2.824   0.489   0.093
  -1.329   0.736   0.054
  -0.580   1.920   0.008
   0.741   1.868  -0.027
   1.379   0.688  -0.020
   2.727   0.354  -0.052
   2.817  -1.031  -0.023
   1.606  -1.536   0.024
   0.680  -0.487   0.028
  -0.696  -0.472   0.069
  -1.595  -1.520   0.127
A1AAA2(AA1)AAAA=A2
  -2.883   0.196  -0.203
  -2.243  -0.560   0.963
  -1.032  -1.351   0.467
   0.033  -0.377  -0.050
  -0.601   0.511  -1.099
  -1.888   1.224  -0.750
   0.530   0.489   1.111
   1.690   1.364   0.615
   2.803   0.432   0.183
   2.429  -0.780  -0.570
   1.163  -1.148  -0.667
A1AA=A2AAA[A@H]2A1
   1.989  -0.813  -0.180
   2.157   0.503   0.035
   1.072   1.369   0.016
  -0.169   0.779   0.099
  -1.456   1.253  -0.122
  -2.371   0.075  -0.176
  -1.668  -1.063   0.024
  -0.334  -0.690   0.444
   0.778  -1.417  -0.143
A1AA[A@H]2AAA=A2A1
  -2.179  -0.460   0.414
  -2.002   0.979  -0.065
  -0.605   1.507   0.277
   0.427   0.699  -0.513
   1.781   0.952  -0.067
   2.318  -0.235   0.288
   1.296  -1.287   0.219
   0.166  -0.767  -0.216
  -1.205  -1.387  -0.334
A1Aa2aa3AAAa3aa2A1
  -3.488  -0.024  -0.048
  -2.548  -1.205  -0.020
  -1.171  -0.694   0.010
   0.050  -1.391   0.036
   1.241  -0.700   0.062
   2.537  -1.131   0.090
   3.328   0.005  -0.305
   2.529   1.135   0.092
   1.238   0.697   0.063
   0.034   1.387   0.036
  -1.164   0.703   0.009
  -2.584   1.216  -0.022
A1AAA2=A(AAA2)A=A1
  -2.560   0.639   0.348
  -2.230  -0.958  -0.411
  -0.775  -1.605   0.422
   0.458  -0.799   0.148
   0.599   0.549  -0.060
   1.955   0.794  -0.263
   2.638  -0.420  -0.187
   1.743  -1.387   0.066
  -0.290   1.537  -0.092
  -1.535   1.654   0.026
[AH2+]1AA[AH2+]AA1
   1.408  -0.000   0.231
   0.719   1.210  -0.264
  -0.718   1.210   0.264
  -1.408   0.000  -0.231
  -0.719  -1.210   0.264
   0.718  -1.210  -0.264
A1Aa2aa3aaaa3aa2A1
   3.446  -0.147   0.001
   2.621   0.913   0.000
   1.272   0.538  -0.000
   0.128   1.317  -0.000
  -1.155   0.728  -0.000
  -2.355   1.350   0.000
  -3.492   0.692   0.000
  -2.946  -1.010   0.000
  -1.200  -0.685  -0.000
  -0.067  -1.459  -0.001
   1.169  -0.852  -0.000
   2.580  -1.389   0.000
A1AA[A@H]2AAAAA2A1
   2.334  -0.744  -0.222
   2.499   0.654   0.192
   1.245   1.429  -0.225
   0.014   0.783   0.420
  -1.236   1.464  -0.119
  -2.418   0.620  -0.029
  -2.356  -0.800  -0.385
  -1.212  -1.439   0.409
   0.012  -0.655   0.180
   1.118  -1.309  -0.220
A1AA2=AAA[A@H]2A1
  -2.142  -0.103   0.377
  -1.467   1.143  -0.254
   0.013   0.826  -0.151
   1.197   1.124   0.212
   2.065   0.031   0.226
   1.405  -1.112  -0.086
   0.052  -0.651  -0.546
  -1.123  -1.258   0.224
A1=AAA2(AAAA2)AA1
   2.416   0.071   0.377
   1.804  -1.095   0.576
   0.420  -1.403   0.081
  -0.302  -0.110  -0.296
  -0.624   0.632   0.885
  -2.058   0.771   0.925
  -2.547  -0.386   0.018
  -1.516  -0.421  -0.998
   0.610   0.728  -1.200
   1.798   1.217  -0.370
a1aaa2a[a+]aaa2a1
   2.374  -0.686  -0.005
   2.369   0.707  -0.003
   1.199   1.404   0.000
  -0.019   0.708   0.001
  -1.259   1.371   0.004
  -2.358   0.642  -0.001
  -2.313  -0.682  -0.004
  -1.188  -1.356  -0.002
  -0.015  -0.711   0.004
   1.210  -1.393   0.006
A1=Aa2[a+]aaaa2A1
  -2.442   0.060  -0.004
  -1.605   1.157   0.002
  -0.208   0.689   0.001
   0.957   1.413   0.000
   2.108   0.686  -0.001
   2.149  -0.722  -0.001
   0.947  -1.438   0.000
  -0.243  -0.722   0.001
  -1.666  -1.120   0.001
A1AAA2(AA1)AAA=A2
   2.699  -0.087   0.000
   1.875   0.227  -1.250
   0.609  -0.634  -1.255
  -0.207  -0.346  -0.000
   0.609  -0.634   1.255
   1.875   0.228   1.250
  -1.705  -1.446   0.000
  -3.128   0.177   0.000
  -1.909   1.497  -0.000
  -0.720   1.014  -0.000
A1AA2=A(A1)A=AAA2
   2.349   0.027  -0.001
   1.578  -1.072  -0.000
   0.277  -0.691   0.000
   0.248   0.696   0.000
   1.563   1.121  -0.000
  -0.926   1.336   0.000
  -2.061   0.671   0.001
  -2.090  -0.690  -0.002
  -0.937  -1.394   0.002
A1AA2AAA[A@@H]2A1
   2.074  -0.048   0.433
   1.230   1.144   0.322
   0.012   0.805  -0.133
  -1.363   1.332  -0.344
  -2.358  -0.097   0.270
  -1.078  -1.411   0.082
   0.077  -0.605  -0.558
   1.408  -1.120  -0.073
A1AAA2(AA1)AAAAA2
  -2.777   0.402   0.305
  -2.343  -0.482  -0.867
  -1.172  -1.365  -0.433
   0.000  -0.482  -0.000
  -0.433   0.402   1.172
  -1.605   1.285   0.738
   1.172  -1.365   0.433
   2.343  -0.482   0.867
   2.777   0.402  -0.305
   1.605   1.285  -0.738
   0.433   0.402  -1.172
A1=AAa2a[aH]aa2A1
  -2.128   0.642  -0.114
  -2.040  -0.705  -0.105
  -0.902  -1.395   0.106
   0.269  -0.706   0.047
   1.493  -1.142  -0.020
   2.351  -0.031  -0.064
   1.592   1.088  -0.020
   0.307   0.706   0.049
  -0.943   1.544   0.120
A1=AAA2=A(AAA2)A1
   2.169   0.653   0.115
   2.121  -0.686   0.101
   0.954  -1.382  -0.104
  -0.223  -0.687  -0.050
  -0.279   0.669  -0.049
  -1.620   1.076   0.021
  -2.446   0.009   0.060
  -1.639  -1.178   0.019
   0.962   1.524  -0.116
A1AAa2a[aH]aa2AA1
  -2.111  -0.021   0.783
  -1.895   1.178  -0.017
  -0.674   1.531  -0.455
   0.493   0.681  -0.190
   1.739   1.113   0.082
   2.516   0.107   0.275
   1.776  -1.074   0.118
   0.508  -0.703  -0.176
  -0.556  -1.549  -0.413
  -1.796  -1.259  -0.003
A1A=AA2=A(AAA2)A1
  -2.141   0.635   0.052
  -2.124  -0.648   0.046
  -1.015  -1.335  -0.000
   0.225  -0.677  -0.058
   0.234   0.686  -0.058
   1.653   1.198  -0.124
   2.534  -0.010   0.267
   1.638  -1.206  -0.124
  -1.005   1.358  -0.000
A1AA[A@H]2AAAA2A1
   2.096  -0.654  -0.459
   2.110   0.803   0.017
   0.755   1.462  -0.255
  -0.321   0.737   0.559
  -1.724   1.119   0.061
  -2.319  -0.168  -0.333
  -1.415  -1.144  -0.161
  -0.222  -0.703   0.242
   1.042  -1.448   0.326
A1=AAa2aaaaa2A=A1
  -2.757  -0.014  -0.000
  -2.305   1.197  -0.000
  -0.856   1.647  -0.000
   0.336   0.715  -0.000
   1.540   1.371  -0.000
   2.720   0.636  -0.000
   2.680  -0.758  -0.001
   1.466  -1.422  -0.001
   0.284  -0.684   0.005
  -0.927  -1.529  -0.001
  -2.186  -1.157  -0.001
A1AAA2=A(AA1)AAA2
   2.622   0.000   0.565
   1.975   1.339   0.720
   0.915   1.666  -0.723
  -0.518   0.658  -0.385
  -0.518  -0.658  -0.386
   0.915  -1.666  -0.723
   1.974  -1.339   0.720
  -2.104  -1.344  -0.012
  -3.154   0.000   0.236
  -2.104   1.343  -0.012
a1aaa2AA=[A+]a2a1
   2.111   0.763   0.000
   2.175  -0.620  -0.001
   1.008  -1.367  -0.001
  -0.209  -0.735   0.000
  -1.640  -1.224   0.000
  -2.445   0.060   0.001
  -1.599   1.053  -0.003
  -0.294   0.662   0.001
   0.893   1.407   0.001
A1AAA2AAA[A@H]2A1
   2.067   0.706   0.277
   2.221  -0.708  -0.060
   0.901  -1.422   0.112
  -0.228  -0.735  -0.140
  -1.616  -1.193  -0.043
  -2.444   0.042   0.360
  -1.560   1.260   0.028
  -0.264   0.676  -0.568
   0.926   1.377   0.038
A1A[A@@H]2AAAA2A1
   2.210  -0.084  -0.098
   1.215  -1.272  -0.112
  -0.035  -0.620   0.502
  -1.274  -1.113  -0.097
  -2.125  -0.068  -0.227
  -1.363   1.211   0.063
   0.052   0.802   0.102
   1.323   1.145  -0.133
A1A=Aa2aaaaa2A=A1
  -2.366  -0.052   0.840
  -2.033  -1.263   0.013
  -0.851  -1.481  -0.441
   0.241  -0.702  -0.219
   1.459  -1.353   0.027
   2.608  -0.629   0.246
   2.573   0.757   0.225
   1.387   1.416  -0.010
   0.204   0.697  -0.232
  -1.030   1.465  -0.464
  -2.187   1.144   0.017
A1AAA2=[A+]AAA2A1
  -2.145  -0.675   0.036
  -2.142   0.656   0.022
  -0.969   1.492  -0.195
   0.292   0.675  -0.001
   1.477   1.163   0.138
   2.472   0.073   0.152
   1.649  -1.158  -0.299
   0.277  -0.702  -0.038
  -0.912  -1.521   0.183
A1[AH2+]AA[AH2+]1
  -0.040  -1.221   0.196
   1.109  -0.430  -0.228
   0.820   0.943   0.178
  -0.701   1.046  -0.070
  -1.186  -0.339  -0.078
A1AAA2(AA1)A=AAA2
  -2.621   0.001   0.036
  -1.790  -1.249   0.331
  -0.545  -1.254  -0.559
   0.280  -0.000  -0.290
  -0.543   1.255  -0.555
  -1.788   1.250   0.334
   1.532  -0.000  -1.135
   2.536   0.003  -0.316
   2.141  -0.000   1.019
   0.796  -0.005   1.131
A1AAA2=A(A1)AAAA2
  -2.436  -0.656   0.386
  -2.434   0.670  -0.384
  -1.234   1.493   0.083
   0.025   0.670   0.032
   0.023  -0.671  -0.033
  -1.242  -1.485  -0.084
   1.221  -1.346  -0.057
   2.390  -0.687  -0.032
   2.420   0.657   0.030
   1.270   1.356   0.062
a1aaa2aa[a+]aa2a1
   2.370  -0.744  -0.000
   2.404   0.650   0.000
   1.255   1.380   0.001
   0.017   0.719  -0.000
  -1.202   1.416   0.000
  -2.377   0.690  -0.000
  -2.372  -0.641  -0.001
  -1.266  -1.346   0.003
  -0.019  -0.701  -0.002
   1.188  -1.419  -0.001
a1aaa2aaa[a+]a2a1
  -2.364   0.735  -0.001
  -2.396  -0.657  -0.001
  -1.242  -1.383   0.001
  -0.007  -0.721   0.001
   1.213  -1.443   0.002
   2.394  -0.726  -0.004
   2.352   0.677   0.001
   1.204   1.414   0.001
   0.030   0.694   0.001
  -1.181   1.409  -0.000
A1AAa2aa[a+]aa2A1
   2.346   0.730  -0.370
   2.383  -0.610   0.376
   1.242  -1.418  -0.071
   0.048  -0.704  -0.033
  -1.159  -1.407  -0.062
  -2.348  -0.710  -0.033
  -2.429   0.647   0.034
  -1.241   1.315   0.058
   0.003   0.683   0.030
   1.159   1.473   0.072
A1A=AA2AA[A@H]2A1
  -1.782  -0.647   0.019
  -1.799   0.697   0.054
  -0.655   1.464  -0.028
   0.533   0.692  -0.120
   1.821   0.731   0.233
   1.930  -0.781   0.113
   0.549  -0.749  -0.530
  -0.595  -1.410   0.256
A1AAAA2(AA1)AAAA2
   2.444  -0.607  -0.005
   2.052   0.556  -0.874
   1.395   1.696  -0.073
   0.404   1.182   0.991
  -0.449   0.052   0.486
   0.211  -1.288   0.870
   1.299  -1.640  -0.030
  -1.863   0.110   1.084
  -2.838   0.212  -0.108
  -2.049  -0.390  -1.297
  -0.607   0.116  -1.044
A1AAa2aa[aH]a2AA1
   2.116   0.051   0.771
   1.774   1.282  -0.013
   0.526   1.552  -0.416
  -0.526   0.679  -0.173
  -1.787   1.020   0.119
  -2.513  -0.056   0.278
  -1.746  -1.148   0.101
  -0.467  -0.702  -0.189
   0.704  -1.526  -0.453
   1.920  -1.154  -0.025
a1aaa2aa[aH+]a2a1
  -2.101  -0.697  -0.002
  -2.103   0.693  -0.001
  -0.931   1.393   0.000
   0.286   0.706   0.000
   1.582   1.066   0.001
   2.311   0.006  -0.000
   1.597  -1.066  -0.001
   0.286  -0.707  -0.001
  -0.926  -1.395   0.004
A1AAa2[aH]aaa2AA1
   2.560  -0.051  -0.237
   1.831  -1.040   0.637
   0.581  -1.549  -0.034
  -0.558  -0.709  -0.062
  -1.867  -1.049  -0.312
  -2.600   0.059  -0.093
  -1.805   1.055   0.214
  -0.539   0.637   0.207
   0.680   1.515   0.370
   1.716   1.132  -0.690
A1AAa2aaaa[a+]2A1
  -2.372  -0.701   0.411
  -2.417   0.612  -0.222
  -1.305   1.358  -0.000
   0.004   0.653  -0.009
   1.172   1.410   0.052
   2.410   0.764   0.055
   2.421  -0.630  -0.003
   1.213  -1.316  -0.070
   0.048  -0.672  -0.069
  -1.178  -1.474  -0.144
A1A=Aa2[aH]aaa2A1
   2.101   0.659  -0.000
   2.049  -0.703  -0.001
   0.908  -1.355  -0.001
  -0.261  -0.704   0.004
  -1.572  -1.096  -0.001
  -2.338   0.034  -0.001
  -1.572   1.086  -0.000
  -0.274   0.696  -0.000
   0.961   1.385   0.000
A1AAA2(AA1)AA=AA2
   2.616   0.228  -0.036
   1.943  -1.013  -0.625
   0.723  -1.382   0.225
  -0.251  -0.213   0.253
   0.409   1.041   0.808
   1.630   1.398  -0.044
  -0.796   0.031  -1.052
  -2.153   0.396  -0.883
  -2.616   0.086   0.281
  -1.503  -0.573   1.076
A1AAa2aa[aH+]a2A1
  -2.118   0.712  -0.387
  -2.218  -0.676   0.255
  -0.963  -1.460  -0.097
   0.290  -0.701  -0.011
   1.672  -1.135  -0.052
   2.423  -0.005   0.077
   1.565   1.072  -0.152
   0.303   0.683   0.146
  -0.957   1.507   0.219
A1AAa2[a+]aaaa2A1
  -2.425  -0.639   0.375
  -2.343   0.709  -0.354
  -1.150   1.377   0.056
   0.013   0.677   0.026
   1.157   1.352   0.060
   2.327   0.745   0.039
   2.409  -0.632  -0.019
   1.238  -1.376  -0.058
   0.024  -0.706  -0.036
  -1.251  -1.506  -0.087
A1AA2=A(A1)AA=AA2
   2.543   0.588   0.000
   1.426   1.337   0.000
   0.181   0.681   0.000
   0.272  -0.719   0.000
   1.969  -1.020   0.000
  -0.827  -1.511   0.000
  -2.092  -0.978   0.000
  -2.284   0.369  -0.001
  -1.184   1.250   0.000
A1AAAAAAAAAAAAAA1
  -3.107  -0.841  -0.388
  -3.267   0.535   0.261
  -2.366   1.489  -0.421
  -1.465   2.133   0.375
  -0.512   3.118  -0.250
   0.833   3.057   0.476
   1.848   2.312  -0.393
   2.479   1.290   0.381
   3.419   0.154  -0.266
   2.842  -1.300   0.113
   1.586  -1.788  -0.363
   1.097  -2.915   0.549
  -0.288  -3.376   0.093
  -1.023  -2.208  -0.568
  -2.077  -1.658   0.395
A1AAa2aaa[a+]a2A1
   2.405   0.706   0.389
   2.441  -0.616  -0.387
   1.272  -1.481   0.081
  -0.015  -0.702   0.032
  -1.221  -1.422   0.059
  -2.422  -0.719   0.032
  -2.379   0.668  -0.030
  -1.222   1.390  -0.060
  -0.055   0.669  -0.031
   1.195   1.510  -0.084
A1A=AA2=A(A1)AAA2
  -2.169   0.653   0.113
  -2.120  -0.686   0.105
  -0.954  -1.382  -0.104
   0.223  -0.687  -0.051
   0.279   0.669  -0.049
  -0.962   1.524  -0.117
   1.620   1.076   0.021
   2.446   0.010   0.063
   1.639  -1.178   0.015
a1aaa2[a+]aaaa2a1
   2.315  -0.648   0.000
   2.338   0.676   0.001
   1.220   1.388   0.000
  -0.018   0.695  -0.001
  -1.185   1.416  -0.001
  -2.326   0.682  -0.001
  -2.363  -0.719   0.004
  -1.199  -1.430  -0.002
   0.015  -0.718  -0.001
   1.201  -1.340  -0.001
a1aaa2AA[AH+]a2a1
  -2.126  -0.746  -0.050
  -2.174   0.640  -0.050
  -0.994   1.367   0.007
   0.219   0.710   0.058
   1.640   1.234   0.117
   2.479  -0.006  -0.268
   1.597  -1.126   0.126
   0.271  -0.672   0.058
  -0.911  -1.397  -0.002
A1=AAa2[aH]aaa2A1
   2.150   0.628  -0.113
   2.088  -0.711  -0.101
   0.924  -1.402   0.106
  -0.272  -0.688   0.047
  -1.545  -1.120  -0.017
  -2.377   0.011  -0.064
  -1.623   1.084  -0.026
  -0.297   0.682   0.045
   0.956   1.516   0.119
A1AA=[A+]A[AH2+]1
   1.357   0.321   0.348
   0.404   1.419  -0.134
  -1.011   0.916  -0.073
  -1.406  -0.330   0.043
  -0.332  -1.386   0.140
   0.988  -0.939  -0.326
A1A=Aa2aa[aH]a2A1
   2.074  -0.633   0.003
   2.064   0.649   0.004
   0.954   1.356  -0.002
  -0.280   0.696  -0.009
  -1.576   1.080   0.001
  -2.344   0.027   0.006
  -1.587  -1.103   0.000
  -0.269  -0.712  -0.003
   0.967  -1.358  -0.003
A1AAAAAAAAAAAAA1
  -1.180   2.296   0.337
  -1.826   1.345  -0.398
  -3.066   0.802   0.198
  -3.181  -0.685  -0.163
  -2.046  -1.403   0.473
  -1.283  -2.129  -0.406
  -0.071  -2.852   0.124
   1.176  -2.187  -0.400
   1.945  -1.462   0.475
   3.131  -0.822  -0.153
   3.118   0.666   0.200
   1.927   1.290  -0.414
   1.281   2.218   0.351
   0.074   2.918  -0.218
A1AAa2a[aH]aa2A1
   2.110   0.691   0.383
   2.126  -0.634  -0.382
   0.965  -1.519   0.090
  -0.301  -0.700   0.042
  -1.575  -1.132   0.071
  -2.377  -0.045   0.004
  -1.559   1.093  -0.069
  -0.318   0.702  -0.045
   0.930   1.548  -0.092
A1AAAa2aaaaa2AA1
  -2.280   0.744   1.044
  -1.295  -0.446   1.149
  -1.632  -1.529   0.096
  -0.450  -1.762  -0.625
   0.582  -0.862  -0.343
   1.825  -1.192   0.140
   2.714  -0.179   0.461
   2.376   1.158   0.307
   1.134   1.512  -0.199
   0.262   0.511  -0.535
  -1.093   0.618  -1.132
  -2.142   1.429  -0.368
A1=AAa2aaaaa2AA1
  -2.551   0.016  -0.638
  -2.083   1.217  -0.411
  -0.991   1.423   0.559
   0.278   0.707   0.314
   1.394   1.380   0.150
   2.635   0.670  -0.205
   2.621  -0.638  -0.351
   1.376  -1.392  -0.139
   0.265  -0.761   0.192
  -0.854  -1.465   0.434
  -2.094  -1.161   0.092
A1AAA2=A(AAA2)A1
  -2.116  -0.661  -0.003
  -2.093   0.684   0.001
  -0.930   1.361   0.000
   0.270   0.682   0.000
   0.264  -0.685   0.001
   1.598  -1.125   0.000
   2.402   0.002  -0.001
   1.572   1.112  -0.001
  -0.968  -1.367   0.002
A1A=Aa2aaaaa2AA1
   2.386  -0.021  -0.840
   2.177   1.155   0.003
   1.019   1.456   0.474
  -0.213   0.689   0.232
  -1.395   1.411   0.003
  -2.581   0.753  -0.232
  -2.616  -0.632  -0.244
  -1.465  -1.354  -0.015
  -0.252  -0.704   0.220
   0.863  -1.498   0.440
   2.082  -1.256  -0.037
A1=AAA2AA=AAA2A1
   1.957  -0.880   0.752
   2.412   0.240   0.130
   1.568   1.058  -0.679
   0.082   0.773  -0.746
  -0.557   1.382   0.508
  -1.927   0.827   0.740
  -2.374  -0.263   0.206
  -1.577  -1.113  -0.737
  -0.121  -0.748  -0.713
   0.538  -1.276   0.539
A1AAa2aa[a+]a2A1
  -2.230   0.355  -0.416
  -2.131  -0.965   0.354
  -0.840  -1.687  -0.060
   0.278  -0.701  -0.025
   2.028  -0.982  -0.055
   2.513   0.686   0.019
   1.352   1.309   0.059
   0.194   0.652   0.039
  -1.168   1.336   0.081
A1AAA2=A(A1)AAA2
  -2.524  -0.614   0.456
  -2.523   0.614  -0.458
  -1.167   1.703   0.041
   0.276   0.668   0.015
   0.276  -0.668  -0.012
  -1.167  -1.703  -0.041
   1.904  -1.371  -0.024
   3.025   0.000  -0.002
   1.904   1.371   0.024
A1AAA2(AAAA2)AA1
  -2.431  -0.259   0.347
  -1.940   0.961   0.609
  -0.639   1.426   0.008
   0.254   0.216  -0.262
   0.674  -0.434   1.068
   2.135  -0.888   0.822
   2.710   0.260  -0.044
   1.542   0.656  -0.972
  -0.501  -0.797  -1.121
  -1.807  -1.138  -0.451
a1aaa2a[aH]aa2a1
  -2.125   0.703   0.004
  -2.057  -0.686  -0.002
  -0.931  -1.350  -0.001
   0.262  -0.731   0.000
   1.576  -1.156   0.001
   2.364  -0.069   0.001
   1.576   1.089  -0.000
   0.306   0.739  -0.001
  -0.967   1.460  -0.002
[aH]1aaa2aaaa2a1
   2.034  -0.974   0.001
   2.201   0.377   0.000
   1.104   1.210  -0.000
  -0.152   0.664  -0.001
  -1.342   1.318  -0.002
  -2.511   0.618   0.003
  -1.963  -1.029  -0.001
  -0.215  -0.707  -0.000
   0.844  -1.473   0.000
A1=AAa2aaaa2A=A1
   2.204   0.544  -0.662
   2.045  -0.823  -0.706
   1.037  -1.627   0.503
  -0.481  -0.780   0.197
  -1.632  -1.296  -0.137
  -2.501  -0.359  -0.291
  -1.947   0.813  -0.057
  -0.636   0.574   0.270
   0.346   1.489   0.618
   1.568   1.462   0.263
A1A[A@@H]2AAA2A1
  -1.431   0.964   0.659
  -1.631  -0.732  -0.050
   0.100  -0.947  -0.644
   1.074  -1.312   0.485
   1.555   0.123   0.417
   0.656   0.426  -0.559
  -0.325   1.481  -0.309
a1a[aH]a2aaaa2a1
  -2.104  -0.699   0.001
  -2.084   0.664   0.000
  -0.933   1.353  -0.002
   0.268   0.711  -0.001
   1.534   1.115   0.004
   2.322   0.048  -0.002
   1.601  -1.056  -0.001
   0.305  -0.711  -0.000
  -0.905  -1.422   0.001
a1aaa2aa[a+]a2a1
   2.083   0.720  -0.003
   2.109  -0.691  -0.001
   0.971  -1.424   0.004
  -0.310  -0.740   0.000
  -1.585  -1.043  -0.001
  -2.237  -0.018  -0.005
  -1.609   1.021   0.005
  -0.324   0.744   0.003
   0.900   1.430  -0.002
A1AAA2=AA=AAA2A1
  -2.276   1.227   0.073
  -2.608  -0.133  -0.540
  -1.640  -1.394   0.335
  -0.031  -0.711   0.097
   0.987  -1.525  -0.142
   2.222  -1.068  -0.328
   2.542   0.221  -0.021
   1.489   1.118   0.583
   0.161   0.639   0.140
  -0.843   1.628  -0.194
a1aaa2aa[aH]a2a1
   2.131   0.715   0.003
   2.143  -0.680  -0.002
   0.957  -1.387  -0.000
  -0.259  -0.697   0.000
  -1.660  -1.115   0.001
  -2.397  -0.043   0.001
  -1.589   1.098  -0.000
  -0.265   0.709  -0.001
   0.939   1.404  -0.002
A1AAA2=AAAA=A2A1
  -2.409  -0.703   0.391
  -2.438   0.616  -0.389
  -1.271   1.483   0.081
   0.016   0.703   0.033
   1.196   1.396   0.065
   2.412   0.697   0.032
   2.410  -0.648  -0.028
   1.243  -1.336  -0.063
   0.046  -0.691  -0.036
  -1.209  -1.521  -0.083
A1=AA2AA[A@H]2A1
   1.715   0.011  -0.347
   0.972   1.094  -0.034
  -0.286   0.757   0.488
  -1.369   0.784  -0.316
  -1.570  -0.707  -0.379
  -0.390  -0.704   0.591
   0.925  -1.232  -0.006
a1[aH]aa2aaaa2a1
  -2.084  -0.707   0.002
  -2.096   0.652  -0.003
  -0.952   1.372   0.002
   0.280   0.715   0.001
   1.564   1.108  -0.000
   2.327   0.034  -0.000
   1.584  -1.063  -0.001
   0.300  -0.708  -0.000
  -0.927  -1.404  -0.000
a1aa2aaa[a+]a2a1
   2.571   0.650   0.003
   1.407   1.398   0.001
   0.138   0.694   0.001
  -1.179   1.244  -0.002
  -2.275   0.370  -0.002
  -2.059  -1.022  -0.000
  -0.816  -1.584   0.003
   0.230  -0.717   0.003
   1.979  -1.031  -0.003
a1[a+]aa2aaaa2a1
  -2.066   1.017   0.001
  -2.300  -0.332  -0.003
  -1.205  -1.141   0.002
   0.134  -0.666   0.001
   1.382  -1.412  -0.000
   2.545  -0.744  -0.000
   2.043   0.967  -0.000
   0.286   0.738  -0.000
  -0.815   1.573   0.001
A1A[AH+]2AAAA2A1
   2.152  -0.213   0.217
   0.970  -1.190   0.438
  -0.036  -0.726  -0.532
  -1.389  -1.125  -0.082
  -2.157   0.180   0.207
  -1.021   1.214   0.426
   0.041   0.733  -0.591
   1.439   1.125  -0.085
a1aaa2[aH]aaa2a1
  -2.108  -0.700  -0.004
  -2.069   0.682   0.002
  -0.925   1.337   0.001
   0.241   0.706  -0.000
   1.553   1.128  -0.001
   2.339   0.016  -0.001
   1.598  -1.053   0.000
   0.289  -0.696   0.001
  -0.917  -1.418   0.002
a1[a+]aa2AAAa2a1
  -2.115  -0.710   0.001
  -2.207   0.646   0.004
  -1.020   1.332   0.002
   0.225   0.700  -0.003
   1.624   1.153  -0.007
   2.428   0.073   0.006
   1.709  -1.065   0.002
   0.274  -0.711  -0.001
  -0.917  -1.416  -0.005
A1AA2AAA[A@H]2A1
   2.207  -0.135  -0.209
   1.423   1.164   0.080
   0.005   0.800   0.114
  -1.296   1.137  -0.105
  -2.070   0.006  -0.252
  -1.371  -1.103   0.070
  -0.026  -0.621   0.555
   1.128  -1.248  -0.253
A1=AA=a2aaaaa2A1
  -2.365   0.706  -0.000
  -2.349  -0.675   0.001
  -1.195  -1.325  -0.001
  -0.034  -0.674  -0.000
   1.170  -1.403  -0.000
   2.358  -0.735   0.001
   2.363   0.667  -0.000
   1.197   1.350  -0.000
   0.004   0.693  -0.000
  -1.147   1.397  -0.000
A1AAa2[aH]aaa2A1
  -2.079   0.688  -0.001
  -2.108  -0.655   0.000
  -0.967  -1.375   0.001
   0.273  -0.701   0.001
   1.594  -1.101  -0.003
   2.345   0.018   0.002
   1.568   1.070   0.000
   0.288   0.688   0.000
  -0.918   1.370  -0.000
A1AAa2aa[aH]a2A1
  -2.128  -0.704   0.377
  -2.153   0.628  -0.378
  -0.984   1.504   0.091
   0.277   0.680   0.042
   1.606   1.130   0.071
   2.402   0.041   0.002
   1.605  -1.068  -0.068
   0.304  -0.670  -0.042
  -0.930  -1.537  -0.094
A1A[A@H]2AAAA2A1
  -2.200   0.106   0.131
  -1.184   1.277   0.149
   0.031   0.616  -0.512
   1.303   1.107   0.005
   2.092   0.054   0.320
   1.355  -1.216  -0.065
  -0.058  -0.805  -0.115
  -1.338  -1.140   0.087
a1aaa2[a+]aaa2a1
   2.093  -0.678  -0.001
   2.095   0.727  -0.001
   0.915   1.403   0.000
  -0.295   0.680   0.001
  -1.564   1.062   0.001
  -2.347  -0.018  -0.003
  -1.564  -1.121   0.001
  -0.265  -0.693   0.001
   0.929  -1.358   0.000
A1A[AH+]2AAA1AA2
  -0.746   0.148   1.435
   0.784   0.185   1.383
   1.254   0.032  -0.013
   0.736   1.139  -0.845
  -0.812   1.141  -0.848
  -1.289  -0.035   0.013
  -0.727  -1.342  -0.561
   0.803  -1.265  -0.561
A1AAA2(AA1)AAAA2
   2.622  -0.063   0.040
   1.852   1.011  -0.731
   0.600   1.406   0.056
  -0.285   0.176   0.254
   0.481  -0.905   1.016
   1.733  -1.294   0.226
  -0.714  -0.373  -1.122
  -2.189  -0.789  -0.864
  -2.627   0.296   0.152
  -1.470   0.534   0.971
a1a[a+]a2AAAa2a1
   2.162  -0.715   0.056
   2.122   0.672   0.052
   0.966   1.397   0.001
  -0.194   0.676  -0.060
  -1.604   1.224  -0.130
  -2.517   0.045   0.269
  -1.665  -1.180  -0.127
  -0.231  -0.701  -0.059
   0.965  -1.421  -0.001
a1aaa2AAA[a+]2a1
   2.131   0.717   0.055
   2.178  -0.669   0.054
   0.981  -1.361  -0.004
  -0.216  -0.663  -0.058
  -1.632  -1.206  -0.124
  -2.516  -0.000   0.264
  -1.604   1.181  -0.128
  -0.227   0.656  -0.057
   0.906   1.346  -0.001
A1AAA[AH2+]AAA1
   0.307   1.424  -0.718
   1.615   0.924  -0.100
   1.310  -0.284   0.793
   1.024  -1.504  -0.082
  -0.331  -1.396  -0.662
  -1.301  -0.998   0.383
  -1.842   0.391   0.029
  -0.784   1.445   0.354
A1AAa2aaaaa2AA1
   2.783   0.558  -0.392
   2.337  -0.833  -0.793
   1.313  -1.556   0.529
  -0.266  -0.800   0.234
  -1.337  -1.574  -0.180
  -2.576  -0.961  -0.391
  -2.709   0.416  -0.187
  -1.628   1.166   0.227
  -0.398   0.557   0.432
   0.777   1.411   0.862
   1.705   1.616  -0.337
A1Aa2[aH]aaa2A1
   2.258   0.016   0.256
   1.360   1.212  -0.130
  -0.055   0.684  -0.051
  -1.342   1.093   0.021
  -2.155  -0.047   0.066
  -1.383  -1.101   0.023
  -0.052  -0.668  -0.052
   1.367  -1.188  -0.131
A1AAAa2aaaa2AA1
  -1.658  -0.656   1.133
  -2.580   0.058   0.167
  -1.857   0.931  -0.842
  -0.681   1.672  -0.220
   0.553   0.785  -0.065
   1.798   1.391   0.422
   2.944   0.618   0.429
   2.388  -0.907  -0.172
   0.673  -0.514  -0.395
  -0.398  -1.463  -0.856
  -1.178  -1.910   0.394
a1aaa2AA=AAa2a1
   2.389  -0.758  -0.001
   2.433   0.631  -0.000
   1.280   1.363   0.002
   0.046   0.709   0.002
  -1.219   1.456  -0.004
  -2.467   0.682   0.001
  -2.423  -0.623   0.000
  -1.221  -1.333   0.000
  -0.006  -0.700   0.001
   1.185  -1.424  -0.001
A1=AA2AAAA2=AA1
  -2.121  -0.722   0.053
  -0.986  -1.380   0.199
   0.213  -0.679   0.052
   1.554  -1.223  -0.129
   2.504  -0.015  -0.271
   1.661   1.155   0.289
   0.239   0.694   0.109
  -0.884   1.439   0.007
  -2.180   0.733  -0.310
A1A2AA3A(A2)A13
   0.541   1.235   0.666
   1.264  -0.000   0.008
   0.514   0.000  -1.372
  -0.956   0.000  -0.870
  -0.952  -0.787   0.451
   0.541  -1.235   0.666
  -0.951   0.787   0.451
a1aaa2AAA=Aa2a1
  -2.404  -0.705   0.004
  -2.416   0.684  -0.001
  -1.238   1.398  -0.001
  -0.023   0.714  -0.001
   1.266   1.417   0.000
   2.402   0.688   0.001
   2.379  -0.707   0.001
   1.274  -1.391  -0.000
  -0.015  -0.699  -0.001
  -1.225  -1.396  -0.002
A1Aa2aa[aH]a2A1
   2.245   0.033  -0.004
   1.358  -1.226   0.002
  -0.054  -0.682   0.001
  -1.399  -1.073  -0.000
  -2.142   0.002  -0.001
  -1.303   1.121  -0.000
  -0.003   0.671   0.001
   1.298   1.153   0.002
a1aaa2=AAA=a2a1
  -2.105  -0.765  -0.000
  -2.172   0.619  -0.001
  -1.014   1.373  -0.001
   0.222   0.736   0.005
   1.616   1.216  -0.001
   2.433  -0.031  -0.000
   1.604  -1.058  -0.000
   0.300  -0.675  -0.001
  -0.886  -1.413  -0.000
A1AA2AAAA(A1)A2
  -1.764   0.007  -0.676
  -1.229   1.184  -0.313
   0.006   1.239   0.552
   1.250   1.170  -0.300
   1.754  -0.012  -0.690
   1.214  -1.184  -0.321
  -0.007  -1.231   0.564
  -1.241  -1.171  -0.301
   0.018  -0.002   1.488
A1AAa2aaaa2A=A1
   2.138  -0.342  -0.824
   1.713  -1.536  -0.021
   0.460  -1.651   0.447
  -0.489  -0.684   0.222
  -2.214  -0.937  -0.118
  -2.718   0.768  -0.251
  -1.575   1.439  -0.043
  -0.347   0.699   0.205
   0.959   1.371   0.406
   2.073   0.875  -0.025
A1=AAa2aaaa2=A1
   2.058   1.002   0.001
   2.221  -0.367   0.002
   1.101  -1.198  -0.004
  -0.152  -0.653   0.001
  -1.345  -1.335   0.001
  -2.509  -0.686   0.001
  -1.977   1.019  -0.000
  -0.223   0.714  -0.000
   0.824   1.501  -0.000
A1A[AH+]2AAA1A2
  -1.233  -0.764   0.504
  -1.192   0.782   0.513
   0.005   1.047  -0.293
   1.195   0.775   0.513
   1.227  -0.771   0.505
  -0.004  -1.149  -0.380
   0.000   0.077  -1.363
A1AA=A2AAAA2=A1
  -2.094   0.656   0.001
  -2.060  -0.690   0.000
  -0.905  -1.354  -0.000
   0.247  -0.703  -0.001
   1.565  -1.098  -0.001
   2.349  -0.005   0.004
   1.588   1.107  -0.002
   0.248   0.711  -0.001
  -0.935   1.375   0.000
A1A=Aa2aaaa2=A1
  -2.011   1.088  -0.002
  -2.220  -0.361   0.004
  -1.196  -1.161  -0.002
   0.125  -0.645   0.000
   1.292  -1.380   0.000
   2.492  -0.766   0.000
   2.020   0.956   0.000
   0.256   0.718   0.000
  -0.755   1.549  -0.001
A1AA2AAA(A1)AA2
  -1.731   0.036   0.067
  -1.059   1.252   0.598
   0.277   1.356  -0.138
   1.418   0.822   0.707
   1.255  -0.659   1.019
   0.299  -1.340   0.090
  -1.156  -1.237   0.467
   0.530  -0.850  -1.342
   0.171   0.623  -1.470
a1aa2aaaa2[aH]1
  -2.109   0.133  -0.001
  -1.261   1.158   0.000
   0.030   0.657  -0.000
   1.383   1.019  -0.000
   2.119  -0.059  -0.001
   1.262  -1.181  -0.001
  -0.049  -0.690   0.004
  -1.373  -1.034  -0.001
A1AAAAAA=AAAAA1
  -0.218  -2.026   0.524
   0.885  -2.381  -0.475
   2.162  -1.615  -0.121
   1.967  -0.152  -0.426
   2.065   0.756   0.582
   1.783   2.164   0.242
   0.380   2.252  -0.306
  -0.534   1.367   0.083
  -1.903   1.429  -0.448
  -2.798   0.473  -0.100
  -2.319  -0.684   0.672
  -1.471  -1.580  -0.232
A1AA=a2aaaa2AA1
  -2.015   0.424   0.907
  -1.789   1.340  -0.294
  -0.363   1.688  -0.314
   0.521   0.751  -0.191
   2.249   0.885   0.191
   2.607  -0.865   0.244
   1.422  -1.397  -0.042
   0.323  -0.600  -0.298
  -0.986  -1.169  -0.689
  -1.973  -1.060   0.485
A1Aa2a[aH]aa2A1
  -2.256  -0.048  -0.257
  -1.333  -1.225   0.130
   0.070  -0.667   0.052
   1.371  -1.031  -0.018
   2.122   0.011  -0.060
   1.383   1.102  -0.032
   0.035   0.683   0.051
  -1.389   1.176   0.136
A1A[A@H]2AAA2A1
  -1.414   0.990  -0.660
  -1.645  -0.725   0.050
   0.086  -0.946   0.642
   1.055  -1.325  -0.486
   1.558   0.102  -0.415
   0.663   0.418   0.560
  -0.301   1.488   0.310
A1AAA2=AAAA2AA1
   2.638  -0.328   0.173
   1.924   0.693  -0.711
   0.877   1.452   0.095
  -0.457   0.715   0.041
  -1.626   1.372   0.193
  -2.808   0.615   0.156
  -2.199  -0.985  -0.110
  -0.537  -0.621  -0.157
   0.553  -1.561  -0.376
   1.632  -1.354   0.693
A1=Aa2aaaaa2AA1
   2.339   0.731  -0.036
   1.201   1.355   0.129
   0.008   0.684   0.078
  -1.193   1.390  -0.013
  -2.387   0.706  -0.101
  -2.400  -0.682  -0.087
  -1.208  -1.389   0.009
  -0.013  -0.712   0.097
   1.288  -1.465   0.233
   2.361  -0.617  -0.309
A1A=Aa2aaaaa2A1
  -2.409  -0.597   0.001
  -2.288   0.754  -0.004
  -1.145   1.373   0.001
   0.031   0.698   0.001
   1.198   1.333   0.001
   2.337   0.677  -0.000
   2.381  -0.710  -0.001
   1.200  -1.429  -0.000
   0.002  -0.716   0.001
  -1.306  -1.385   0.001
A1AAA2(AAAA2)A1
   2.186   0.724  -0.197
   2.297  -0.683   0.177
   0.907  -1.281  -0.146
  -0.002  -0.048  -0.028
  -0.831  -0.104   1.268
  -2.232   0.315   0.762
  -2.244  -0.066  -0.647
  -1.000   0.006  -1.151
   0.918   1.141  -0.038
A1AAA2(A1)AAAA2
  -2.308   0.387   0.523
  -2.101  -0.700  -0.458
  -0.823  -0.386  -1.151
   0.064   0.169  -0.018
  -0.919   0.964   0.859
   0.657  -0.899   0.724
   1.998  -1.016   0.184
   2.348   0.462  -0.124
   1.082   1.017  -0.543
A1A=AA=a2aaaa12
   1.062  -1.227  -0.002
   2.195  -0.407  -0.002
   2.072   0.903  -0.000
   0.901   1.445   0.003
  -0.188   0.718   0.003
  -1.927   1.090  -0.003
  -2.528  -0.591   0.003
  -1.414  -1.280   0.001
  -0.177  -0.649   0.001
A1=AA=A2AAAA2A1
  -2.269  -0.335  -0.002
  -2.060   1.047  -0.001
  -0.815   1.500   0.000
   0.226   0.688  -0.000
   1.966   1.065   0.001
   2.639  -0.637  -0.000
   1.345  -1.465  -0.001
   0.118  -0.670  -0.001
  -1.148  -1.195   0.004
A1AA=A2AAAAA2A1
  -2.578  -0.289  -0.395
  -2.403   0.988   0.428
  -1.029   1.548   0.165
   0.024   0.718  -0.069
   1.623   1.424  -0.334
   2.601   0.164   0.534
   2.310  -1.127  -0.098
   0.960  -1.601   0.060
  -0.130  -0.652  -0.084
  -1.378  -1.173  -0.206
A1Aa2aa[a+]a2A1
   2.233   0.026  -0.249
   1.338  -1.173   0.133
  -0.043  -0.675   0.051
  -1.340  -1.114  -0.027
  -2.120  -0.018  -0.068
  -1.324   1.060  -0.019
  -0.076   0.672   0.051
   1.334   1.224   0.131
A1AAA2(AA1)AAA2
  -2.400   0.121   0.103
  -1.681  -1.130  -0.402
  -0.390  -1.344   0.393
   0.526  -0.138   0.193
  -0.188   1.167   0.446
  -1.549   1.361  -0.190
   1.306  -0.165  -1.126
   2.505   0.382  -0.333
   1.871  -0.254   0.917
A1AA=a2aaaaa2A1
   2.285  -0.706  -0.442
   2.397   0.605   0.128
   1.183   1.336   0.065
   0.039   0.692   0.046
  -1.176   1.420  -0.033
  -2.352   0.746  -0.071
  -2.351  -0.661  -0.041
  -1.192  -1.343   0.048
   0.006  -0.685   0.097
   1.164  -1.404   0.204
A1=AAa2aaaaa2A1
  -2.397   0.691   0.000
  -2.470  -0.687   0.001
  -1.221  -1.467  -0.003
   0.044  -0.714   0.001
   1.275  -1.374   0.001
   2.434  -0.649   0.000
   2.392   0.747  -0.001
   1.178   1.415  -0.001
  -0.008   0.692   0.000
  -1.226   1.344   0.000
a1aa2aa[aH]a2a1
  -2.227  -0.742   0.001
  -1.015  -1.366   0.001
   0.159  -0.599  -0.000
   1.524  -0.788  -0.001
   2.132   0.358  -0.002
   1.214   1.365   0.003
  -0.013   0.787  -0.001
  -1.775   0.984  -0.001
a1aa2[a+]aaa2a1
  -2.217   0.710  -0.001
  -1.742  -1.011   0.001
   0.019  -0.770   0.001
   1.194  -1.327  -0.003
   2.136  -0.360   0.002
   1.505   0.840   0.001
   0.137   0.596   0.000
  -1.034   1.322  -0.001
A1AAa2aaaa2=A1
  -2.102   1.050  -0.191
  -2.194  -0.324   0.476
  -1.191  -1.287  -0.168
   0.153  -0.661  -0.084
   1.316  -1.355  -0.048
   2.505  -0.711   0.040
   1.995   1.002   0.075
   0.248   0.724  -0.033
  -0.730   1.566  -0.067
A1=AAa2aaaa2A1
  -2.126   0.600   0.099
  -2.098  -0.742   0.107
  -0.847  -1.546  -0.119
   0.320  -0.667  -0.047
   1.670  -1.001   0.028
   2.368   0.110   0.066
   1.481   1.193   0.020
   0.228   0.695  -0.046
  -0.999   1.354  -0.106
[AH2+]1AAA=AA1
   1.334  -0.218   0.341
   0.550  -1.256  -0.360
  -0.895  -1.167   0.139
  -1.367   0.259   0.072
  -0.556   1.265  -0.049
   0.935   1.116  -0.144
A1AAA2AAAAA2A1
  -2.498   0.712   0.279
  -2.498  -0.712  -0.279
  -1.249  -1.450   0.206
  -0.000  -0.712  -0.279
   1.249  -1.450   0.206
   2.498  -0.712  -0.279
   2.499   0.712   0.279
   1.249   1.450  -0.206
  -0.000   0.712   0.279
  -1.249   1.450  -0.206
A1AAa2aaaa2AA1
   2.597  -0.057  -0.169
   1.696  -1.187  -0.657
   0.627  -1.493   0.396
  -0.571  -0.613   0.151
  -1.861  -0.964   0.138
  -2.582  -0.010  -0.062
  -1.887   1.094  -0.213
  -0.531   0.715  -0.081
   0.700   1.570  -0.176
   1.810   0.942   0.675
[AH2+]1AAAAAA1
   1.748   0.011   0.017
   0.896   1.176   0.437
  -0.298   1.432  -0.441
  -1.514   0.695   0.158
  -1.497  -0.732  -0.144
  -0.253  -1.436   0.436
   0.920  -1.148  -0.460
a1aaa2aaaaa2a1
   2.402  -0.696  -0.000
   2.400   0.709  -0.002
   1.207   1.410   0.004
  -0.007   0.709  -0.001
  -1.238   1.394  -0.001
  -2.402   0.698  -0.000
  -2.401  -0.709   0.001
  -1.207  -1.412   0.001
   0.007  -0.710  -0.000
   1.238  -1.394  -0.000
a1aa[a+]a[a+]1
  -1.195   0.654   0.002
   0.001   1.366  -0.002
   1.196   0.653   0.000
   1.157  -0.677   0.001
  -0.000  -1.322  -0.000
  -1.157  -0.676  -0.001
a1aaa2AAA=a2a1
   2.079  -0.702   0.003
   2.061   0.638  -0.002
   0.952   1.319  -0.000
  -0.263   0.691  -0.000
  -1.529   1.149   0.001
  -2.355   0.082   0.001
  -1.558  -1.072  -0.000
  -0.306  -0.695  -0.001
   0.923  -1.408  -0.002
a1aaa2=AAAa2a1
   2.081  -0.732  -0.000
   2.128   0.673   0.001
   0.968   1.385   0.001
  -0.260   0.700  -0.000
  -1.584   1.135  -0.000
  -2.381  -0.017  -0.001
  -1.564  -1.087   0.004
  -0.281  -0.678  -0.001
   0.897  -1.377  -0.001
A1AAa2aaaaa2A1
  -2.437   0.655  -0.390
  -2.433  -0.664   0.391
  -1.243  -1.498  -0.080
   0.025  -0.686  -0.034
   1.233  -1.375  -0.066
   2.431  -0.698  -0.033
   2.433   0.697   0.031
   1.221   1.383   0.069
   0.021   0.691   0.033
  -1.252   1.496   0.079
A1AAA2(AA1)AA2
  -2.070   0.000  -0.103
  -1.353   1.214   0.307
  -0.014   1.290  -0.434
   0.768  -0.000  -0.167
  -0.014  -1.290  -0.434
  -1.353  -1.214   0.307
   2.267   0.000  -0.461
   1.770  -0.000   0.986
A1A=AA=A[AH+]1
   0.177  -1.401  -0.230
   1.285  -0.495   0.067
   1.105   0.788   0.112
  -0.173   1.356  -0.095
  -1.266   0.563  -0.069
  -1.129  -0.810   0.217
A1A=A[AH+]A=A1
  -1.286   0.000   0.157
  -0.750  -1.208  -0.033
   0.564  -1.453  -0.090
   1.658  -0.000   0.088
   0.564   1.453  -0.090
  -0.750   1.208  -0.032
A1=AA=A[AH+]A1
   1.142   0.834  -0.070
   1.303  -0.487  -0.126
   0.160  -1.377   0.115
  -1.086  -0.877   0.069
  -1.303   0.493  -0.234
  -0.215   1.412   0.246
A1=AA2AA(A1)A2
   1.602  -0.032   0.012
   0.907  -1.185  -0.010
  -0.608  -1.060  -0.027
  -1.048  -0.042   1.054
  -0.649   1.032   0.029
   0.864   1.285  -0.017
  -1.068   0.003  -1.041
A1=Aa2aaaa2AA1
  -2.056   0.613  -0.001
  -0.969   1.305  -0.001
   0.222   0.693   0.005
   1.556   1.128  -0.001
   2.332   0.028  -0.001
   1.584  -1.042  -0.000
   0.271  -0.686  -0.001
  -0.892  -1.366   0.000
  -2.049  -0.672   0.000
A1AA=AA[AH2+]1
   1.142  -0.883  -0.158
  -0.281  -1.352  -0.031
  -1.305  -0.485   0.083
  -1.075   0.864   0.096
   0.248   1.356  -0.314
   1.271   0.502   0.324
A1AA=A2AAAA2A1
   2.223  -0.302  -0.491
   2.166   1.074   0.177
   0.753   1.609   0.079
  -0.275   0.698   0.048
  -2.010   1.029  -0.071
  -2.640  -0.692  -0.059
  -1.329  -1.489   0.042
  -0.127  -0.672   0.088
   1.237  -1.258   0.183
A1AAAAAAAAAAA1
  -2.350  -0.849   0.409
  -2.459   0.440  -0.409
  -1.910   1.611   0.409
  -0.849   2.350  -0.409
   0.440   2.459   0.409
   1.611   1.910  -0.409
   2.350   0.848   0.409
   2.459  -0.440  -0.409
   1.910  -1.611   0.409
   0.849  -2.350  -0.409
  -0.440  -2.459   0.409
  -1.611  -1.910  -0.409
A1A=Aa2aaaa2A1
   2.085  -0.984   0.002
   2.179   0.372   0.001
   1.147   1.154  -0.000
  -0.136   0.664  -0.000
  -1.343   1.376  -0.001
  -2.522   0.715  -0.000
  -2.014  -0.997   0.001
  -0.260  -0.737   0.001
   0.862  -1.565  -0.004
A1AAAA[AH2+]A1
  -0.423   1.428  -0.422
  -1.618   0.557  -0.005
  -1.225  -0.779   0.364
  -0.255  -1.400  -0.443
   1.140  -1.161   0.169
   1.617   0.146  -0.142
   0.767   1.211   0.479
A1A=AAA=[A+]1
  -0.863   1.153  -0.137
   0.623   1.250   0.069
   1.394   0.141   0.064
   0.810  -1.087  -0.116
  -0.544  -1.228   0.053
  -1.420  -0.231   0.067
a1aaa2AAAa2a1
   2.171  -0.694  -0.054
   2.170   0.694  -0.055
   0.974   1.381   0.002
  -0.226   0.691   0.060
  -1.649   1.204   0.127
  -2.531   0.002  -0.271
  -1.651  -1.202   0.129
  -0.228  -0.692   0.061
   0.970  -1.384  -0.001
A1AA=a2aaaa12
   1.561   0.924  -0.000
   2.287  -0.428  -0.000
   1.170  -1.447   0.001
  -0.025  -0.757  -0.001
  -1.794  -0.981  -0.000
  -2.248   0.746   0.001
  -1.060   1.341  -0.000
   0.109   0.604  -0.000
a1aaa2aaaa2a1
   2.102   0.994   0.001
   2.227  -0.389  -0.000
   1.139  -1.204  -0.002
  -0.171  -0.667  -0.001
  -1.343  -1.330   0.004
  -2.505  -0.714  -0.002
  -2.022   1.007  -0.000
  -0.265   0.745  -0.000
   0.841   1.560   0.001
[AH2+]1AA=AA1
   1.230   0.006  -0.157
   0.390   1.161   0.135
  -1.018   0.648  -0.057
  -1.008  -0.662  -0.057
   0.407  -1.155   0.136
A1A=Aa2aaaa12
  -1.249   1.158  -0.004
  -2.094  -0.044   0.002
  -1.292  -1.075   0.000
  -0.015  -0.662  -0.000
   1.242  -1.078  -0.001
   2.041  -0.071  -0.000
   1.349   1.058   0.001
   0.021   0.714   0.002
A1A=AA[AH2+]1
   0.157   1.196  -0.132
  -1.092   0.448   0.052
  -0.872  -0.810   0.057
   0.607  -1.067  -0.128
   1.202   0.232   0.153
A1=AA2A=AA1A2
   1.238  -0.646   0.483
   1.209   0.673   0.522
  -0.045   1.131  -0.308
  -1.218   0.628   0.547
  -1.177  -0.708   0.524
   0.027  -1.108  -0.341
  -0.035   0.030  -1.428
A1Aa2aaaaa2A1
   2.443   0.018  -0.000
   1.600  -1.240  -0.001
   0.181  -0.726  -0.000
  -1.053  -1.330  -0.000
  -2.140  -0.568   0.001
  -2.036   0.753   0.002
  -0.864   1.367  -0.003
   0.269   0.666   0.001
   1.596   1.062   0.001
A1AAAA[AH2+]1
  -0.720   1.211  -0.264
   0.721   1.210   0.254
   1.407  -0.001  -0.218
   0.719  -1.211   0.254
  -0.721  -1.210  -0.264
  -1.406   0.000   0.236
A1AA2AAA1A=A2
  -1.277   0.515  -0.942
   0.178   0.811  -1.334
   1.229   0.300  -0.352
   1.047  -1.224  -0.270
  -0.389  -1.560   0.136
  -1.197  -0.278   0.376
  -0.426   0.566   1.380
   0.835   0.871   1.007
A1AA2AAA=A2A1
   2.319   0.759  -0.001
   0.967   1.436  -0.000
  -0.132   0.614   0.001
  -1.599   0.888   0.002
  -2.277  -0.487  -0.003
  -1.127  -1.464   0.002
   0.041  -0.746   0.001
   1.809  -1.002  -0.000
A1AAA[AH2+]A1
   0.706   1.248  -0.254
   1.450   0.000   0.230
   0.707  -1.248  -0.254
  -0.732  -1.212   0.266
  -1.400   0.000  -0.255
  -0.733   1.211   0.266
A1AA[AH2+]AA1
   1.101  -0.894  -0.222
  -0.265  -1.398   0.254
  -1.351  -0.438  -0.243
  -1.040   0.920   0.255
   0.276   1.356  -0.258
   1.280   0.456   0.216
A1AA2AA(A1)A2
   1.621  -0.000  -0.208
   0.863  -1.247   0.270
  -0.631  -1.048  -0.039
  -1.259  -0.000   0.899
  -0.631   1.048  -0.039
   0.864   1.247   0.270
  -0.826  -0.000  -1.154
a1[aH]aa[a+]1
   0.106  -1.131  -0.001
  -1.058  -0.445   0.002
  -0.743   0.887  -0.002
   0.602   0.969   0.002
   1.092  -0.278  -0.001
A1AAa2aaaa2A1
  -2.114   1.020   0.342
  -2.190  -0.326  -0.387
  -1.143  -1.189   0.062
   0.131  -0.652   0.034
   1.299  -1.412   0.063
   2.505  -0.795   0.029
   2.039   0.929  -0.046
   0.283   0.702  -0.028
  -0.808   1.723  -0.067
A1AA[AH+]A=A1
   1.469   0.193  -0.155
   0.853  -1.116   0.349
  -0.516  -1.301  -0.322
  -1.433  -0.183   0.099
  -0.849   1.094   0.065
   0.474   1.312  -0.035
a1aa[aH][a+]1
   0.841   0.798   0.001
  -0.540   1.019   0.001
  -1.155  -0.187  -0.002
  -0.196  -1.137   0.002
   1.048  -0.494  -0.002
A1AAAA=[A+]A1
  -0.714   1.395  -0.292
  -1.668   0.278   0.125
  -1.166  -1.091  -0.284
   0.110  -1.379   0.388
   1.270  -0.901  -0.186
   1.572   0.395  -0.235
   0.597   1.305   0.481
A1Aa2aaaa2A1
  -2.233   0.026  -0.249
  -1.338  -1.173   0.134
   0.042  -0.675   0.050
   1.340  -1.114  -0.027
   2.120  -0.018  -0.068
   1.324   1.059  -0.018
   0.076   0.672   0.051
  -1.334   1.224   0.130
a1aa2aaaa2a1
  -2.193   0.342   0.004
  -1.194   1.419  -0.002
   0.033   0.782  -0.001
   1.800   0.961   0.000
   2.210  -0.779   0.001
   1.003  -1.343   0.000
  -0.144  -0.573  -0.001
  -1.517  -0.811  -0.002
A1AAA[AH2+]1
   0.419  -1.164   0.251
  -1.011  -0.771  -0.197
  -1.049   0.752   0.062
   0.426   1.194   0.077
   1.215  -0.009  -0.193
A1AAAA=[A+]1
  -0.832   1.164  -0.160
   0.617   1.226   0.334
   1.369   0.120  -0.287
   0.812  -1.074   0.089
  -0.549  -1.216   0.067
  -1.418  -0.220  -0.043
A1A=AA=AA=A1
  -0.275  -1.585  -0.000
  -1.418  -0.765   0.001
  -1.482   0.611   0.001
  -0.438   1.533  -0.001
   0.922   1.304  -0.002
   1.605   0.091   0.003
   1.087  -1.190  -0.002
A1AA2(A1)AA2
   1.803  -0.000   0.297
   0.818   1.062  -0.223
  -0.276  -0.000  -0.071
   0.819  -1.062  -0.224
  -1.688   0.000  -0.648
  -1.477  -0.000   0.869
A1AAa2aaaa12
   1.310  -1.229  -0.116
   2.159   0.011   0.249
   1.290   1.096  -0.126
   0.006   0.657  -0.048
  -1.225   1.121   0.025
  -2.089   0.094   0.059
  -1.386  -1.051   0.011
  -0.062  -0.699  -0.051
A1=AAA[AH+]1
   0.978  -0.650   0.000
   1.004   0.655   0.000
  -0.298   1.354  -0.001
  -1.441  -0.026   0.000
  -0.243  -1.334  -0.001
A1AAA=[A+]A1
  -0.608   1.260   0.350
  -1.411   0.157  -0.351
  -0.883  -1.198   0.131
   0.616  -1.216   0.062
   1.446  -0.192  -0.052
   0.840   1.190  -0.139
A1AAAAAAAAA1
   0.406   1.839   0.330
  -0.975   1.666  -0.305
  -1.856   0.816   0.612
  -2.487  -0.320  -0.196
  -1.638  -1.584  -0.048
  -0.219  -1.293  -0.461
   0.784  -1.509   0.460
   2.130  -1.148  -0.077
   2.390   0.322   0.262
   1.466   1.208  -0.576
A1AA2AAAA2A1
  -1.650   0.084   0.715
  -1.447  -0.959  -0.106
  -0.102  -0.770  -0.778
   1.009  -1.275   0.162
   1.648  -0.092   0.718
   1.448   0.974  -0.105
   0.104   0.771  -0.773
  -1.010   1.270   0.167
A1AA2AAA1AA2
   0.765   1.410  -0.305
  -0.765   1.410  -0.305
  -1.275  -0.000  -0.000
  -0.765  -0.441   1.373
   0.765  -0.441   1.374
   1.275   0.000   0.000
   0.765  -0.969  -1.068
  -0.765  -0.969  -1.069
A1AA[A+]=AA1
   1.421  -0.166  -0.304
   0.582  -1.280   0.340
  -0.858  -1.151  -0.164
  -1.420   0.244  -0.032
  -0.545   1.237   0.073
   0.819   1.118   0.087
A1AA=A[AH+]1
  -0.478  -1.181   0.002
   1.010  -0.781  -0.002
   0.976   0.732   0.001
  -0.310   1.129   0.001
  -1.200   0.100  -0.002
a1aaa[a+]a1
   0.716   1.181  -0.003
   1.404  -0.020   0.002
   0.675  -1.201   0.000
  -0.706  -1.144  -0.001
  -1.414   0.018   0.000
  -0.674   1.164   0.002
A1=AA=AA=A1
  -1.333   0.310  -0.000
  -0.357   1.395  -0.000
   0.932   1.179   0.001
   1.437  -0.299  -0.000
   0.288  -1.482  -0.000
  -0.968  -1.105  -0.000
A1AAAA=AAA1
  -0.528   1.094   0.896
   0.441   1.691  -0.105
   1.324   0.644  -0.779
   1.714  -0.447   0.229
   0.617  -1.424   0.461
  -0.582  -1.586   0.038
  -1.266  -0.555  -0.834
  -1.721   0.583   0.094
A1AA2AAA1A2
  -1.239  -0.775  -0.512
  -1.239   0.775  -0.511
   0.000   1.120   0.368
   1.239   0.775  -0.512
   1.239  -0.775  -0.512
  -0.000  -1.120   0.368
   0.000  -0.000   1.313
A1AA[AH2+]1
  -1.052   0.071   0.147
  -0.019  -1.032  -0.143
   1.053   0.035   0.147
   0.017   0.926  -0.151
a1[a-]aaaa1
   1.371   0.181   0.001
   0.842  -1.097  -0.002
  -0.529  -1.277   0.001
  -1.371  -0.181   0.001
  -0.842   1.096  -0.002
   0.529   1.277   0.001
A1AAA=[A+]1
   0.554   1.125  -0.001
  -0.961   0.836   0.002
  -1.019  -0.636  -0.002
   0.257  -1.115   0.002
   1.171  -0.212  -0.000
[aH+]1aaaa1
   1.123   0.006   0.133
   0.323   1.090  -0.114
  -0.892   0.639   0.048
  -0.891  -0.646   0.048
   0.337  -1.090  -0.114
a1aa[a+]aa1
  -1.203  -0.638   0.001
  -0.019  -1.365   0.000
   1.187  -0.668  -0.002
   1.165   0.662   0.003
   0.017   1.321  -0.002
  -1.148   0.690  -0.000
A1AA=AA=A1
   0.278  -1.309   0.000
  -1.004  -0.899   0.002
  -1.301   0.431  -0.003
  -0.294   1.335   0.002
   1.039   0.873  -0.000
   1.280  -0.431  -0.001
A1AAAA=AA1
   1.536  -0.516   0.070
   0.539  -1.634  -0.136
  -0.826  -1.408   0.492
  -1.697  -0.080  -0.367
  -0.948   1.318   0.430
   0.290   1.574   0.200
   1.109   0.744  -0.692
[aH]1aaaa1
  -1.144   0.000  -0.002
  -0.328  -1.082   0.003
   0.901  -0.643  -0.002
   0.901   0.643   0.001
  -0.328   1.082   0.001
A1AA2AA1A2
  -1.213   0.790   0.037
  -1.230  -0.768   0.057
   0.313  -1.035   0.009
   0.993   0.015   0.975
   0.335   1.022  -0.017
   0.802  -0.025  -1.060
a1aaa[aH]1
  -0.108   1.131   0.003
  -1.094   0.277  -0.002
  -0.599  -0.970   0.001
   0.745  -0.884   0.001
   1.057   0.448  -0.002
A1AAA=AAA1
   0.074   1.446  -0.516
   0.925   0.916   0.601
   1.387  -0.337   0.584
   0.929  -1.251  -0.368
  -0.386  -1.428  -0.540
  -1.518  -0.517   0.461
  -1.413   1.172  -0.222
A1=AA=AAA1
  -1.351  -0.236  -0.002
  -0.915   1.019   0.003
   0.536   1.245  -0.002
   1.337   0.201  -0.000
   0.858  -0.993   0.001
  -0.463  -1.234   0.000
A1AAAAAAA1
  -1.350   0.001   0.798
  -1.371   1.250  -0.085
   0.013   1.463  -0.700
   1.086   1.248   0.370
   1.901  -0.001   0.031
   1.084  -1.250   0.370
   0.011  -1.463  -0.700
  -1.373  -1.248  -0.085
A1A=AAA=A1
   1.336  -0.230   0.121
   0.900   1.052  -0.060
  -0.418   1.330  -0.066
  -1.444   0.252   0.129
  -0.838  -1.108  -0.064
   0.463  -1.294  -0.062
[a-]1aaaa1
  -1.113  -0.229  -0.001
  -0.569   0.995   0.002
   0.735   0.814  -0.002
   1.015  -0.439   0.002
  -0.066  -1.141  -0.001
a1aaa[a+]1
  -0.489   0.963  -0.002
  -1.091  -0.089   0.001
  -0.220  -1.113   0.001
   1.016  -0.545  -0.002
   0.784   0.784   0.002
A1=AAA=A1
  -0.218  -1.305   0.001
   0.921  -0.631  -0.000
   0.930   0.633  -0.002
  -0.244   1.311   0.003
  -1.387  -0.009  -0.001
A1AAA=AA1
   0.368   1.292   0.000
   1.330   0.353   0.001
   1.004  -0.957   0.000
  -0.418  -1.329  -0.002
  -1.349  -0.330   0.003
  -0.936   0.972  -0.002
A1AAAAAA1
  -1.502   0.713   0.149
  -0.279   1.437  -0.451
   0.904   1.202   0.450
   1.756  -0.000   0.000
   0.903  -1.202  -0.450
  -0.280  -1.437   0.450
  -1.502  -0.712  -0.148
A1AAAA=A1
  -0.796  -1.155  -0.085
   0.528  -1.381  -0.153
   1.659  -0.075   0.201
   0.671   1.332  -0.380
  -0.729   1.203   0.152
  -1.334   0.077   0.264
A1AA=AAA1
  -0.501  -1.306   0.067
   0.972  -1.099  -0.133
   1.352   0.339   0.069
   0.450   1.315   0.065
  -0.906   1.031  -0.124
  -1.369  -0.279   0.056
a1aaaaa1
   1.200  -0.692   0.003
  -0.000  -1.381  -0.002
  -1.200  -0.691  -0.000
  -1.207   0.688   0.001
   0.000   1.389  -0.000
   1.207   0.687  -0.002
A1AAAAA1
   0.703   1.247  -0.255
   1.446  -0.001   0.233
   0.702  -1.248  -0.255
  -0.743  -1.199   0.247
  -1.367   0.000  -0.216
  -0.742   1.199   0.247
A1AAA=A1
   0.590  -1.000  -0.001
   1.227   0.192   0.001
   0.124   1.233  -0.001
  -1.148   0.410   0.000
  -0.792  -0.834   0.000
A1AA=AA1
  -1.305   0.000  -0.163
  -0.372   1.197   0.136
   1.025   0.652  -0.055
   1.024  -0.653  -0.055
  -0.372  -1.197   0.136
A1A=AAA1
  -0.028   1.145   0.002
   1.132   0.340  -0.001
   0.653  -0.934  -0.001
  -0.688  -0.851   0.002
  -1.068   0.298  -0.002
A1AA=A1
   0.294   0.987   0.001
   1.011  -0.311  -0.001
  -0.312  -0.951   0.002
  -0.992   0.275  -0.002
A1AAAA1
  -0.783  -1.009  -0.200
   0.734  -1.068   0.074
   1.238   0.386   0.074
   0.009   1.278  -0.200
  -1.198   0.413   0.251
a1aaaa1
  -0.188  -1.354  -0.002
   1.002  -0.639   0.003
   0.908   0.730  -0.002
  -0.322   1.311   0.000
  -1.401  -0.046   0.000
A1AAA1
   0.334   1.006  -0.173
  -1.007   0.333   0.173
  -0.333  -1.005  -0.173
   1.006  -0.334   0.173
