COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.406  -2.760   1.245  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.966  -2.708   1.403  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.795  -2.926   0.319  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.291  -2.869   0.491  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.863   1.789  -0.047  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.529   4.076  -0.438  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.256   3.581  -0.622  1.00  0.00           C  
HETATM    8  C   UNL     1       4.687  -1.317  -0.824  1.00  0.00           C  
HETATM    9  C   UNL     1       2.769  -0.451   0.517  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.252  -3.195  -0.924  1.00  0.00           C  
HETATM   11  C   UNL     1       0.120  -3.248  -1.081  1.00  0.00           C  
HETATM   12  C   UNL     1       0.949  -3.024   0.002  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.758  -1.500   0.260  1.00  0.00           N  
HETATM   14  C   UNL     1      -5.070  -1.209   0.361  1.00  0.00           C  
HETATM   15  O   UNL     1      -5.866  -2.082   0.642  1.00  0.00           O  
HETATM   16  N   UNL     1      -5.499   0.051   0.149  1.00  0.00           N  
HETATM   17  C   UNL     1      -6.802   0.450   0.222  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.904   2.809  -0.132  1.00  0.00           C  
HETATM   19  N   UNL     1      -6.261   4.415  -0.660  1.00  0.00           N  
HETATM   20  C   UNL     1      -5.470   2.223  -0.310  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.693   1.100  -0.170  1.00  0.00           C  
HETATM   22  S   UNL     1       2.699  -3.091  -0.199  1.00  0.00           S  
HETATM   23  O   UNL     1       3.186  -3.438   1.090  1.00  0.00           O  
HETATM   24  O   UNL     1       2.891  -3.954  -1.311  1.00  0.00           O  
HETATM   25  C   UNL     1       3.171  -1.392  -0.622  1.00  0.00           C  
HETATM   26  C   UNL     1       5.087   0.130  -1.121  1.00  0.00           C  
HETATM   27  N   UNL     1       4.681   0.990  -0.002  1.00  0.00           N  
HETATM   28  C   UNL     1       3.224   0.971   0.182  1.00  0.00           C  
HETATM   29  C   UNL     1       5.171   2.362  -0.188  1.00  0.00           C  
HETATM   30  C   UNL     1       4.734   3.228   0.997  1.00  0.00           C  
HETATM   31  C   UNL     1       5.315   4.635   0.833  1.00  0.00           C  
HETATM   32  O   UNL     1       6.739   4.553   0.738  1.00  0.00           O  
HETATM   33  C   UNL     1       7.206   3.795  -0.380  1.00  0.00           C  
HETATM   34  C   UNL     1       6.701   2.354  -0.267  1.00  0.00           C  
HETATM   35  H   UNL     1       1.054  -2.590   2.093  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.391  -2.497   2.373  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.765  -3.539  -0.227  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.553  -3.177   1.503  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.289   4.840  -0.505  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.254   3.937  -0.814  1.00  0.00           H  
HETATM   41  H   UNL     1       5.192  -1.656   0.080  1.00  0.00           H  
HETATM   42  H   UNL     1       4.974  -1.954  -1.661  1.00  0.00           H  
HETATM   43  H   UNL     1       1.686  -0.467   0.638  1.00  0.00           H  
HETATM   44  H   UNL     1       3.244  -0.776   1.443  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.900  -3.365  -1.771  1.00  0.00           H  
HETATM   46  H   UNL     1       0.545  -3.454  -2.053  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.122  -0.802   0.036  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.644  -0.186   0.454  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.941   2.562   0.042  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.620   1.057  -0.290  1.00  0.00           H  
HETATM   51  H   UNL     1       2.666  -1.090  -1.539  1.00  0.00           H  
HETATM   52  H   UNL     1       6.167   0.189  -1.251  1.00  0.00           H  
HETATM   53  H   UNL     1       4.592   0.464  -2.033  1.00  0.00           H  
HETATM   54  H   UNL     1       2.739   1.301  -0.737  1.00  0.00           H  
HETATM   55  H   UNL     1       2.953   1.642   0.997  1.00  0.00           H  
HETATM   56  H   UNL     1       4.761   2.773  -1.111  1.00  0.00           H  
HETATM   57  H   UNL     1       3.646   3.284   1.026  1.00  0.00           H  
HETATM   58  H   UNL     1       5.101   2.787   1.925  1.00  0.00           H  
HETATM   59  H   UNL     1       4.916   5.090  -0.073  1.00  0.00           H  
HETATM   60  H   UNL     1       5.043   5.244   1.696  1.00  0.00           H  
HETATM   61  H   UNL     1       6.831   4.239  -1.302  1.00  0.00           H  
HETATM   62  H   UNL     1       8.296   3.799  -0.391  1.00  0.00           H  
HETATM   63  H   UNL     1       7.107   1.895   0.635  1.00  0.00           H  
HETATM   64  H   UNL     1       7.020   1.787  -1.141  1.00  0.00           H  
CONECT    1   12    2    2   35                                       
CONECT    2    1    1    3   36                                       
CONECT    3   10   10    2    4                                       
CONECT    4    3   13   37   38                                       
CONECT    5   17   17   20   18                                       
CONECT    6   18   18   19   39                                       
CONECT    7   20   19   19   40                                       
CONECT    8   26   25   41   42                                       
CONECT    9   28   25   43   44                                       
CONECT   10   11    3    3   45                                       
CONECT   11   12   12   10   46                                       
CONECT   12   22   11   11    1                                       
CONECT   13    4   14   47                                            
CONECT   14   15   15   13   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   21   17                                            
CONECT   17   16    5    5   48                                       
CONECT   18    5    6    6   49                                       
CONECT   19    7    7    6                                            
CONECT   20   21   21    5    7                                       
CONECT   21   16   20   20   50                                       
CONECT   22   25   24   24   23                                       
CONECT   22   23   12                                                 
CONECT   23   22   22                                                 
CONECT   24   22   22                                                 
CONECT   25    8    9   22   51                                       
CONECT   26   27    8   52   53                                       
CONECT   27   29   26   28                                            
CONECT   28   27    9   54   55                                       
CONECT   29   34   30   27   56                                       
CONECT   30   31   29   57   58                                       
CONECT   31   32   30   59   60                                       
CONECT   32   33   31                                                 
CONECT   33   32   34   61   62                                       
CONECT   34   33   29   63   64                                       
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   13                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   21                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   28                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
CONECT   60   31                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
CONECT   63   34                                                      
CONECT   64   34                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
