COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.650  -2.096  -0.263  1.00  0.00           C  
HETATM    2  C   UNL     1       9.744  -1.063  -0.179  1.00  0.00           C  
HETATM    3  C   UNL     1      11.085  -1.348  -0.766  1.00  0.00           C  
HETATM    4  C   UNL     1       5.417   2.229   1.061  1.00  0.00           C  
HETATM    5  C   UNL     1       3.514   3.371   0.398  1.00  0.00           C  
HETATM    6  C   UNL     1       8.151  -1.469   2.505  1.00  0.00           C  
HETATM    7  C   UNL     1       7.460  -0.796   1.470  1.00  0.00           C  
HETATM    8  C   UNL     1       6.951   0.427   1.704  1.00  0.00           C  
HETATM    9  C   UNL     1       6.437   0.720  -0.608  1.00  0.00           C  
HETATM   10  C   UNL     1       6.918  -0.462  -0.921  1.00  0.00           C  
HETATM   11  C   UNL     1       7.316  -1.458   0.129  1.00  0.00           C  
HETATM   12  C   UNL     1       8.964  -3.250   0.691  1.00  0.00           C  
HETATM   13  C   UNL     1       7.913  -4.321   0.547  1.00  0.00           C  
HETATM   14  C   UNL     1       2.642   3.482  -0.854  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.887  -1.007  -1.722  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.710  -1.444  -0.508  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.578  -0.706   0.644  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.140  -1.625  -0.470  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.867  -2.356  -0.961  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.326   1.671   0.241  1.00  0.00           C  
HETATM   21  C   UNL     1      -9.063   1.813   1.531  1.00  0.00           C  
HETATM   22  C   UNL     1     -10.203   2.155   2.278  1.00  0.00           C  
HETATM   23  C   UNL     1     -10.209   0.030   3.178  1.00  0.00           C  
HETATM   24  C   UNL     1      -8.543   0.516   1.672  1.00  0.00           C  
HETATM   25  C   UNL     1       4.663   4.401   0.338  1.00  0.00           C  
HETATM   26  C   UNL     1       5.948   3.541   0.428  1.00  0.00           C  
HETATM   27  N   UNL     1       9.374  -1.048   2.884  1.00  0.00           N  
HETATM   28  N   UNL     1       6.287   1.102   0.718  1.00  0.00           N  
HETATM   29  N   UNL     1      -7.451   0.454   0.844  1.00  0.00           N  
HETATM   30  N   UNL     1      -8.271   2.468   0.649  1.00  0.00           N  
HETATM   31  N   UNL     1     -10.761   3.418   2.181  1.00  0.00           N  
HETATM   32  N   UNL     1     -10.734   1.238   3.079  1.00  0.00           N  
HETATM   33  N   UNL     1      -9.143  -0.335   2.498  1.00  0.00           N  
HETATM   34  O   UNL     1       7.641  -2.429   3.053  1.00  0.00           O  
HETATM   35  O   UNL     1       7.904  -5.370   1.385  1.00  0.00           O  
HETATM   36  O   UNL     1       7.079  -4.235  -0.323  1.00  0.00           O  
HETATM   37  O   UNL     1       9.535  -0.005   0.364  1.00  0.00           O  
HETATM   38  O   UNL     1      12.062  -0.426  -0.691  1.00  0.00           O  
HETATM   39  O   UNL     1      11.294  -2.411  -1.311  1.00  0.00           O  
HETATM   40  O   UNL     1       4.113   2.066   0.462  1.00  0.00           O  
HETATM   41  O   UNL     1       1.527   2.597  -0.738  1.00  0.00           O  
HETATM   42  O   UNL     1       1.042   2.124  -3.170  1.00  0.00           O  
HETATM   43  O   UNL     1      -0.404   3.842  -2.017  1.00  0.00           O  
HETATM   44  O   UNL     1      -0.626   1.279  -1.474  1.00  0.00           O  
HETATM   45  O   UNL     1      -0.891  -0.814  -3.043  1.00  0.00           O  
HETATM   46  O   UNL     1      -2.365   1.218  -3.303  1.00  0.00           O  
HETATM   47  O   UNL     1      -2.761  -0.244  -1.285  1.00  0.00           O  
HETATM   48  O   UNL     1      -5.295  -0.294   0.125  1.00  0.00           O  
HETATM   49  O   UNL     1      -8.087  -2.553   0.064  1.00  0.00           O  
HETATM   50  O   UNL     1      -9.676  -3.072  -1.965  1.00  0.00           O  
HETATM   51  O   UNL     1     -10.425  -3.682   0.481  1.00  0.00           O  
HETATM   52  O   UNL     1     -10.241  -1.282  -0.277  1.00  0.00           O  
HETATM   53  O   UNL     1      -5.759  -3.641  -0.346  1.00  0.00           O  
HETATM   54  O   UNL     1       4.586   5.300   1.445  1.00  0.00           O  
HETATM   55  O   UNL     1       6.918   4.160   1.275  1.00  0.00           O  
HETATM   56  P   UNL     1       0.399   2.453  -1.878  1.00  0.00           P  
HETATM   57  P   UNL     1      -1.676   0.378  -2.298  1.00  0.00           P  
HETATM   58  P   UNL     1      -9.621  -2.618  -0.421  1.00  0.00           P  
HETATM   59  H   UNL     1       8.586  -2.475  -1.283  1.00  0.00           H  
HETATM   60  H   UNL     1       5.332   2.332   2.143  1.00  0.00           H  
HETATM   61  H   UNL     1       2.908   3.545   1.288  1.00  0.00           H  
HETATM   62  H   UNL     1       7.066   0.878   2.679  1.00  0.00           H  
HETATM   63  H   UNL     1       6.159   1.406  -1.394  1.00  0.00           H  
HETATM   64  H   UNL     1       7.025  -0.726  -1.962  1.00  0.00           H  
HETATM   65  H   UNL     1       6.553  -2.234   0.193  1.00  0.00           H  
HETATM   66  H   UNL     1       9.942  -3.666   0.449  1.00  0.00           H  
HETATM   67  H   UNL     1       8.969  -2.882   1.717  1.00  0.00           H  
HETATM   68  H   UNL     1       2.283   4.506  -0.957  1.00  0.00           H  
HETATM   69  H   UNL     1       3.230   3.213  -1.731  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.542  -1.887  -2.263  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.506  -0.396  -2.380  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.073  -1.973   0.200  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.458  -1.259   1.575  1.00  0.00           H  
HETATM   74  H   UNL     1      -7.585  -1.037  -1.273  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.876  -2.451  -2.046  1.00  0.00           H  
HETATM   76  H   UNL     1      -6.554   1.936  -0.466  1.00  0.00           H  
HETATM   77  H   UNL     1     -10.672  -0.685   3.842  1.00  0.00           H  
HETATM   78  H   UNL     1       4.638   4.951  -0.603  1.00  0.00           H  
HETATM   79  H   UNL     1       6.361   3.355  -0.563  1.00  0.00           H  
HETATM   80  H   UNL     1       9.818  -1.464   3.639  1.00  0.00           H  
HETATM   81  H   UNL     1       9.810  -0.328   2.401  1.00  0.00           H  
HETATM   82  H   UNL     1     -10.364   4.079   1.592  1.00  0.00           H  
HETATM   83  H   UNL     1     -11.548   3.642   2.701  1.00  0.00           H  
HETATM   84  H   UNL     1       7.211  -6.031   1.253  1.00  0.00           H  
HETATM   85  H   UNL     1      12.914  -0.656  -1.086  1.00  0.00           H  
HETATM   86  H   UNL     1      -0.851   4.121  -1.206  1.00  0.00           H  
HETATM   87  H   UNL     1      -0.415  -1.406  -2.444  1.00  0.00           H  
HETATM   88  H   UNL     1      -9.287  -3.941  -2.133  1.00  0.00           H  
HETATM   89  H   UNL     1     -11.358  -3.774   0.243  1.00  0.00           H  
HETATM   90  H   UNL     1      -4.950  -4.120  -0.573  1.00  0.00           H  
HETATM   91  H   UNL     1       5.316   5.932   1.490  1.00  0.00           H  
HETATM   92  H   UNL     1       7.214   5.027   0.966  1.00  0.00           H  
CONECT    1    2   12   11   59                                       
CONECT    2   37   37    3    1                                       
CONECT    3    2   39   39   38                                       
CONECT    4   26   40   28   60                                       
CONECT    5   14   25   40   61                                       
CONECT    6    7   34   34   27                                       
CONECT    7   11    8    8    6                                       
CONECT    8   28    7    7   62                                       
CONECT    9   10   10   28   63                                       
CONECT   10    9    9   11   64                                       
CONECT   11   10    1    7   65                                       
CONECT   12    1   13   66   67                                       
CONECT   13   12   36   36   35                                       
CONECT   14   41    5   68   69                                       
CONECT   15   16   47   70   71                                       
CONECT   16   15   48   19   72                                       
CONECT   17   48   18   29   73                                       
CONECT   18   49   19   17   74                                       
CONECT   19   16   53   18   75                                       
CONECT   20   29   30   30   76                                       
CONECT   21   24   30   22   22                                       
CONECT   22   21   21   32   31                                       
CONECT   23   33   32   32   77                                       
CONECT   24   29   33   33   21                                       
CONECT   25   26   54    5   78                                       
CONECT   26   25   55    4   79                                       
CONECT   27    6   80   81                                            
CONECT   28    9    4    8                                            
CONECT   29   17   20   24                                            
CONECT   30   20   20   21                                            
CONECT   31   22   82   83                                            
CONECT   32   23   23   22                                            
CONECT   33   24   24   23                                            
CONECT   34    6    6                                                 
CONECT   35   13   84                                                 
CONECT   36   13   13                                                 
CONECT   37    2    2                                                 
CONECT   38    3   85                                                 
CONECT   39    3    3                                                 
CONECT   40    5    4                                                 
CONECT   41   56   14                                                 
CONECT   42   56   56                                                 
CONECT   43   56   86                                                 
CONECT   44   56   57                                                 
CONECT   45   57   87                                                 
CONECT   46   57   57                                                 
CONECT   47   15   57                                                 
CONECT   48   16   17                                                 
CONECT   49   58   18                                                 
CONECT   50   58   88                                                 
CONECT   51   58   89                                                 
CONECT   52   58   58                                                 
CONECT   53   19   90                                                 
CONECT   54   25   91                                                 
CONECT   55   26   92                                                 
CONECT   56   42   42   43   44                                       
CONECT   56   41                                                      
CONECT   57   44   47   46   46                                       
CONECT   57   45                                                      
CONECT   58   52   52   50   49                                       
CONECT   58   51                                                      
CONECT   59    1                                                      
CONECT   60    4                                                      
CONECT   61    5                                                      
CONECT   62    8                                                      
CONECT   63    9                                                      
CONECT   64   10                                                      
CONECT   65   11                                                      
CONECT   66   12                                                      
CONECT   67   12                                                      
CONECT   68   14                                                      
CONECT   69   14                                                      
CONECT   70   15                                                      
CONECT   71   15                                                      
CONECT   72   16                                                      
CONECT   73   17                                                      
CONECT   74   18                                                      
CONECT   75   19                                                      
CONECT   76   20                                                      
CONECT   77   23                                                      
CONECT   78   25                                                      
CONECT   79   26                                                      
CONECT   80   27                                                      
CONECT   81   27                                                      
CONECT   82   31                                                      
CONECT   83   31                                                      
CONECT   84   35                                                      
CONECT   85   38                                                      
CONECT   86   43                                                      
CONECT   87   45                                                      
CONECT   88   50                                                      
CONECT   89   51                                                      
CONECT   90   53                                                      
CONECT   91   54                                                      
CONECT   92   55                                                      
MASTER        0    0    0    0    0    0    0    0   92    0   92    0
END
