MIN #    DG(kcal/mol)
    1      -28.656
    2      -28.650
    3      -28.506
    4      -28.490
    5      -28.140
    6      -28.134
    7      -25.506
    8      -21.436
    9      -12.744
   10      -12.599
   11      -12.313
   12      -11.701
   13      -10.532
   14      -10.496
   15      -10.216
   16      -10.213
   17      -10.128
   18       -9.623
   19       -9.512
   20       -8.894
   21       -8.519
   22       -8.436
   23       -8.431
   24       -8.342
   25       -8.088
   26       -8.056
   27       -7.495
   28       -6.969
   29       -6.831
   30       -6.765
   31       -5.190
   32       -5.025
   33       -4.606
   34       -4.351
   35       -4.284
   36       -4.192
   37       -4.114
   38       -3.818
   39       -3.793
   40       -3.684
   41       -3.282
   42       -2.693
   43       -2.567
   44       -2.357
   45       -1.196
   46       -1.083
   47       -0.036
   48        0.000
   49        1.527
   50        1.570
   51        3.661
   52        4.076
   53        4.233
   54        4.406
   55        5.727
   56        5.765
   57        5.859
   58        5.914
   59        6.275
   60        7.837
   61        7.895
   62        7.936
   63        7.989
   64        8.228
   65        8.284
   66        8.511
   67        8.687
   68        8.899
   69        9.120
   70        9.779
   71       10.001
   72       10.269
   73       10.359
   74       10.677
   75       11.728
   76       13.251
   77       13.409
   78       13.552
   79       13.665
   80       13.864
   81       14.037
   82       14.087
   83       14.567
   84       14.737
   85       15.715
   86       15.838
   87       16.092
   88       16.509
   89       16.586
   90       16.649
   91       16.772
   92       16.849
   93       17.541
   94       17.991
   95       17.992
   96       18.046
   97       18.471
   98       18.497
   99       18.538
  100       18.572
  101       18.903
  102       19.216
  103       19.381
  104       19.583
  105       20.006
  106       20.836
  107       20.882
  108       21.029
  109       21.585
  110       21.602
  111       23.238
  112       23.998
  113       24.336
  114       24.596
  115       24.610
  116       25.126
  117       25.623
  118       25.958
  119       26.803
  120       28.461
  121       29.226
  122       29.771
  123       30.412
  124       31.557
  125       33.907
  126       35.804
  127       36.451
  128       37.485
  129       37.723
  130       38.650
  131       39.532
  132       40.001
  133       41.253
  134       42.864
  135       45.133
  136       48.110
  137       50.187
  138       51.023
  139       51.525
  140       56.508
  141       57.238
  142       58.143
  143       58.774
  144       59.149
  145       60.326
  146       60.838
  147       61.028
  148       61.059
  149       61.219
  150       61.301
  151       61.485
  152       63.205
  153       63.480
  154       63.646
  155       63.680
  156       64.336
  157       68.679
  158       69.069
  159       69.225
  160       69.230
  161       70.336
  162       73.845
  163       74.097
  164       74.678
  165       75.078
  166       75.902
  167       76.168
  168       76.451
  169       77.224
  170       77.997
  171       78.406
  172       79.079
  173       79.873
  174       80.571
  175       80.758
  176       80.771
  177       81.647
  178       81.705
  179       81.832
  180       82.015
  181       82.389
  182       82.983
  183       83.270
  184       83.931
  185       84.544
  186       84.781
  187       85.279
  188       85.503
  189       86.101
  190       89.845
  191       92.106
  192       93.189
  193       93.385
  194       93.634
  195       94.850
  196       95.707
Conformational isomers are listed in the same line:
1 2 3 4 5 6 8 
9 11 32 
12 25 38 
13 14 21 22 37 44 
15 16 
17 18 
19 28 30 41 
23 24 34 35 
26 27 33 49 
39 40 45 46 
42 43 47 48 
53 57 58 59 62 
55 60 63 64 
74 75 77 78 80 81 84 
76 96 
79 98 
85 87 
86 95 
88 89 92 93 94 99 102 104 105 106 108 109 110 113 119 
91 100 101 
112 116 117 
120 122 123 
124 126 
136 138 
139 141 
144 145 
147 148 149 150 
151 161 
152 156 
153 154 155 
160 165 
162 163 176 
169 175 
171 177 
172 183 185 
173 178 181 
174 180 186 
179 187 
182 184 188 190 
191 195 
192 196 
