COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.010  -4.479   2.042  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.062  -2.951   2.104  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.270  -2.463   3.319  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.013  -1.052   0.604  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.007  -0.262  -0.237  1.00  0.00           C  
HETATM    6  C   UNL     1       0.552   0.955  -0.414  1.00  0.00           C  
HETATM    7  C   UNL     1       1.885   1.277   0.265  1.00  0.00           C  
HETATM    8  C   UNL     1       2.722   2.169  -0.653  1.00  0.00           C  
HETATM    9  C   UNL     1       3.980   2.587   0.063  1.00  0.00           C  
HETATM   10  C   UNL     1       4.168   3.725   0.750  1.00  0.00           C  
HETATM   11  C   UNL     1       6.112   2.609   0.913  1.00  0.00           C  
HETATM   12  C   UNL     1       5.229   1.825   0.148  1.00  0.00           C  
HETATM   13  C   UNL     1       5.648   0.590  -0.350  1.00  0.00           C  
HETATM   14  C   UNL     1       6.914   0.148  -0.091  1.00  0.00           C  
HETATM   15  C   UNL     1       7.789   0.918   0.664  1.00  0.00           C  
HETATM   16  C   UNL     1       7.397   2.139   1.165  1.00  0.00           C  
HETATM   17  C   UNL     1       2.953  -0.780  -0.489  1.00  0.00           C  
HETATM   18  C   UNL     1       3.955  -2.749  -1.392  1.00  0.00           C  
HETATM   19  C   UNL     1       4.842  -1.952  -2.351  1.00  0.00           C  
HETATM   20  C   UNL     1       2.672  -3.167  -2.112  1.00  0.00           C  
HETATM   21  C   UNL     1       4.706  -3.996  -0.920  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.310  -1.178  -0.152  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.453  -0.281  -0.886  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.253   0.987  -0.726  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.102   2.031  -1.625  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.859   3.178  -1.438  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.732   3.241  -0.369  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.151   1.120   0.317  1.00  0.00           C  
HETATM   29  N   UNL     1      -2.475  -2.391   0.880  1.00  0.00           N  
HETATM   30  N   UNL     1       5.436   3.757   1.263  1.00  0.00           N  
HETATM   31  N   UNL     1       2.611   0.032   0.531  1.00  0.00           N  
HETATM   32  N   UNL     1      -5.192  -0.159  -0.152  1.00  0.00           N  
HETATM   33  N   UNL     1      -8.849   2.228   0.468  1.00  0.00           N  
HETATM   34  O   UNL     1       2.659  -0.479  -1.630  1.00  0.00           O  
HETATM   35  O   UNL     1       3.620  -1.923  -0.245  1.00  0.00           O  
HETATM   36  O   UNL     1      -4.561  -2.196  -0.762  1.00  0.00           O  
HETATM   37  S   UNL     1      -0.500   0.021   0.732  1.00  0.00           S  
HETATM   38  H   UNL     1      -1.973  -4.804   1.954  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.445  -4.895   2.951  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.573  -4.827   1.176  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.099  -2.627   2.192  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.379  -1.383   3.413  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.651  -2.946   4.219  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.217  -2.713   3.191  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.189  -0.530   1.544  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.761  -0.828  -1.135  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.443   0.696  -0.519  1.00  0.00           H  
HETATM   48  H   UNL     1       0.052   1.883  -0.692  1.00  0.00           H  
HETATM   49  H   UNL     1       0.734   0.358  -1.308  1.00  0.00           H  
HETATM   50  H   UNL     1       1.698   1.796   1.205  1.00  0.00           H  
HETATM   51  H   UNL     1       2.984   1.618  -1.556  1.00  0.00           H  
HETATM   52  H   UNL     1       2.147   3.055  -0.923  1.00  0.00           H  
HETATM   53  H   UNL     1       3.428   4.501   0.879  1.00  0.00           H  
HETATM   54  H   UNL     1       4.972  -0.015  -0.938  1.00  0.00           H  
HETATM   55  H   UNL     1       7.237  -0.808  -0.476  1.00  0.00           H  
HETATM   56  H   UNL     1       8.787   0.554   0.861  1.00  0.00           H  
HETATM   57  H   UNL     1       8.085   2.731   1.750  1.00  0.00           H  
HETATM   58  H   UNL     1       5.756  -1.654  -1.838  1.00  0.00           H  
HETATM   59  H   UNL     1       5.094  -2.572  -3.212  1.00  0.00           H  
HETATM   60  H   UNL     1       4.308  -1.064  -2.687  1.00  0.00           H  
HETATM   61  H   UNL     1       2.924  -3.787  -2.972  1.00  0.00           H  
HETATM   62  H   UNL     1       2.040  -3.734  -1.428  1.00  0.00           H  
HETATM   63  H   UNL     1       2.137  -2.278  -2.448  1.00  0.00           H  
HETATM   64  H   UNL     1       5.620  -3.698  -0.407  1.00  0.00           H  
HETATM   65  H   UNL     1       4.074  -4.563  -0.237  1.00  0.00           H  
HETATM   66  H   UNL     1       4.957  -4.615  -1.781  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.023  -1.122  -0.493  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.244  -0.446  -1.943  1.00  0.00           H  
HETATM   69  H   UNL     1      -6.411   1.953  -2.451  1.00  0.00           H  
HETATM   70  H   UNL     1      -7.766   4.011  -2.119  1.00  0.00           H  
HETATM   71  H   UNL     1      -9.325   4.131  -0.216  1.00  0.00           H  
HETATM   72  H   UNL     1      -8.278   0.310   1.019  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.468  -2.371   0.938  1.00  0.00           H  
HETATM   74  H   UNL     1       5.805   4.480   1.794  1.00  0.00           H  
HETATM   75  H   UNL     1       2.845  -0.207   1.441  1.00  0.00           H  
HETATM   76  H   UNL     1      -4.992   0.656   0.336  1.00  0.00           H  
CONECT    1    2   38   39   40                                       
CONECT    2    3    1   29   41                                       
CONECT    3    2   42   43   44                                       
CONECT    4   29    5   22   45                                       
CONECT    5   37    4   46   47                                       
CONECT    6    7   37   48   49                                       
CONECT    7    8   31    6   50                                       
CONECT    8    9    7   51   52                                       
CONECT    9   10   10   12    8                                       
CONECT   10   30    9    9   53                                       
CONECT   11   16   30   12   12                                       
CONECT   12   11   11    9   13                                       
CONECT   13   14   14   12   54                                       
CONECT   14   15   13   13   55                                       
CONECT   15   16   16   14   56                                       
CONECT   16   15   15   11   57                                       
CONECT   17   34   34   35   31                                       
CONECT   18   21   20   19   35                                       
CONECT   19   18   58   59   60                                       
CONECT   20   18   61   62   63                                       
CONECT   21   18   64   65   66                                       
CONECT   22    4   32   36   36                                       
CONECT   23   24   32   67   68                                       
CONECT   24   25   25   28   23                                       
CONECT   25   26   24   24   69                                       
CONECT   26   27   27   25   70                                       
CONECT   27   26   26   33   71                                       
CONECT   28   33   33   24   72                                       
CONECT   29    2    4   73                                            
CONECT   30   11   10   74                                            
CONECT   31   17    7   75                                            
CONECT   32   23   22   76                                            
CONECT   33   27   28   28                                            
CONECT   34   17   17                                                 
CONECT   35   18   17                                                 
CONECT   36   22   22                                                 
CONECT   37    6    5                                                 
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    3                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    5                                                      
CONECT   48    6                                                      
CONECT   49    6                                                      
CONECT   50    7                                                      
CONECT   51    8                                                      
CONECT   52    8                                                      
CONECT   53   10                                                      
CONECT   54   13                                                      
CONECT   55   14                                                      
CONECT   56   15                                                      
CONECT   57   16                                                      
CONECT   58   19                                                      
CONECT   59   19                                                      
CONECT   60   19                                                      
CONECT   61   20                                                      
CONECT   62   20                                                      
CONECT   63   20                                                      
CONECT   64   21                                                      
CONECT   65   21                                                      
CONECT   66   21                                                      
CONECT   67   23                                                      
CONECT   68   23                                                      
CONECT   69   25                                                      
CONECT   70   26                                                      
CONECT   71   27                                                      
CONECT   72   28                                                      
CONECT   73   29                                                      
CONECT   74   30                                                      
CONECT   75   31                                                      
CONECT   76   32                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
