COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.599   1.421   0.742  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.958   1.190   0.651  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.426   0.019   0.086  1.00  0.00           C  
HETATM    4  S   UNL     1      -9.160  -0.272  -0.030  1.00  0.00           S  
HETATM    5  O   UNL     1      -9.327  -1.681  -0.110  1.00  0.00           O  
HETATM    6  O   UNL     1      -9.768   0.527   0.976  1.00  0.00           O  
HETATM    7  N   UNL     1      -9.664   0.342  -1.483  1.00  0.00           N  
HETATM    8  C   UNL     1      -6.535  -0.926  -0.390  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.175  -0.700  -0.301  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.703   0.475   0.266  1.00  0.00           C  
HETATM   11  O   UNL     1      -3.366   0.701   0.349  1.00  0.00           O  
HETATM   12  C   UNL     1      -2.503  -0.316  -0.162  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.045   0.114   0.017  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.121  -0.975  -0.530  1.00  0.00           C  
HETATM   15  N   UNL     1       1.278  -0.562  -0.357  1.00  0.00           N  
HETATM   16  C   UNL     1       2.186  -1.464  -1.077  1.00  0.00           C  
HETATM   17  C   UNL     1       3.615  -0.923  -0.997  1.00  0.00           C  
HETATM   18  C   UNL     1       1.631  -0.479   1.066  1.00  0.00           C  
HETATM   19  C   UNL     1       3.044   0.092   1.210  1.00  0.00           C  
HETATM   20  C   UNL     1       4.033  -0.814   0.472  1.00  0.00           C  
HETATM   21  C   UNL     1       5.439  -0.217   0.561  1.00  0.00           C  
HETATM   22  C   UNL     1       6.401  -1.047  -0.292  1.00  0.00           C  
HETATM   23  C   UNL     1       7.846  -0.505  -0.161  1.00  0.00           C  
HETATM   24  C   UNL     1       8.708  -1.737  -0.535  1.00  0.00           C  
HETATM   25  C   UNL     1       7.954  -2.930   0.089  1.00  0.00           C  
HETATM   26  C   UNL     1       6.488  -2.491   0.244  1.00  0.00           C  
HETATM   27  O   UNL     1       5.876  -0.228   1.921  1.00  0.00           O  
HETATM   28  C   UNL     1       5.414   1.202   0.053  1.00  0.00           C  
HETATM   29  N   UNL     1       5.493   1.432  -1.243  1.00  0.00           N  
HETATM   30  C   UNL     1       5.475   2.657  -1.732  1.00  0.00           C  
HETATM   31  C   UNL     1       5.372   3.751  -0.895  1.00  0.00           C  
HETATM   32  C   UNL     1       5.287   3.549   0.474  1.00  0.00           C  
HETATM   33  C   UNL     1       5.304   2.247   0.951  1.00  0.00           C  
HETATM   34  H   UNL     1      -5.235   2.338   1.180  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.656   1.926   1.022  1.00  0.00           H  
HETATM   36  H   UNL     1     -10.419  -0.058  -1.943  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.205   1.102  -1.874  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.903  -1.840  -0.831  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.479  -1.438  -0.673  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.676  -1.246   0.380  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.708  -0.470  -1.221  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.872   1.044  -0.525  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.839   0.267   1.077  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.294  -1.905   0.013  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.327  -1.129  -1.589  1.00  0.00           H  
HETATM   46  H   UNL     1       2.147  -2.455  -0.626  1.00  0.00           H  
HETATM   47  H   UNL     1       1.880  -1.529  -2.122  1.00  0.00           H  
HETATM   48  H   UNL     1       4.291  -1.601  -1.519  1.00  0.00           H  
HETATM   49  H   UNL     1       3.658   0.062  -1.462  1.00  0.00           H  
HETATM   50  H   UNL     1       0.923   0.172   1.578  1.00  0.00           H  
HETATM   51  H   UNL     1       1.595  -1.475   1.508  1.00  0.00           H  
HETATM   52  H   UNL     1       3.077   1.093   0.780  1.00  0.00           H  
HETATM   53  H   UNL     1       3.311   0.139   2.265  1.00  0.00           H  
HETATM   54  H   UNL     1       4.029  -1.805   0.927  1.00  0.00           H  
HETATM   55  H   UNL     1       6.084  -1.045  -1.335  1.00  0.00           H  
HETATM   56  H   UNL     1       8.017   0.313  -0.860  1.00  0.00           H  
HETATM   57  H   UNL     1       8.048  -0.186   0.862  1.00  0.00           H  
HETATM   58  H   UNL     1       8.765  -1.847  -1.618  1.00  0.00           H  
HETATM   59  H   UNL     1       9.705  -1.649  -0.106  1.00  0.00           H  
HETATM   60  H   UNL     1       8.017  -3.796  -0.569  1.00  0.00           H  
HETATM   61  H   UNL     1       8.377  -3.169   1.064  1.00  0.00           H  
HETATM   62  H   UNL     1       6.199  -2.518   1.294  1.00  0.00           H  
HETATM   63  H   UNL     1       5.839  -3.145  -0.339  1.00  0.00           H  
HETATM   64  H   UNL     1       5.312   0.279   2.520  1.00  0.00           H  
HETATM   65  H   UNL     1       5.541   2.806  -2.800  1.00  0.00           H  
HETATM   66  H   UNL     1       5.359   4.751  -1.302  1.00  0.00           H  
HETATM   67  H   UNL     1       5.206   4.385   1.153  1.00  0.00           H  
HETATM   68  H   UNL     1       5.235   2.052   2.011  1.00  0.00           H  
CONECT    1    2   10   10   34                                       
CONECT    2    3    3    1   35                                       
CONECT    3    4    2    2    8                                       
CONECT    4    5    5    7    3                                       
CONECT    4    6    6                                                 
CONECT    5    4    4                                                 
CONECT    6    4    4                                                 
CONECT    7    4   36   37                                            
CONECT    8    3    9    9   38                                       
CONECT    9    8    8   10   39                                       
CONECT   10    1    1    9   11                                       
CONECT   11   10   12                                                 
CONECT   12   11   13   40   41                                       
CONECT   13   14   12   42   43                                       
CONECT   14   15   13   44   45                                       
CONECT   15   18   14   16                                            
CONECT   16   15   17   46   47                                       
CONECT   17   20   16   48   49                                       
CONECT   18   19   15   50   51                                       
CONECT   19   18   20   52   53                                       
CONECT   20   19   21   17   54                                       
CONECT   21   22   20   28   27                                       
CONECT   22   23   26   21   55                                       
CONECT   23   24   22   56   57                                       
CONECT   24   23   25   58   59                                       
CONECT   25   24   26   60   61                                       
CONECT   26   25   22   62   63                                       
CONECT   27   21   64                                                 
CONECT   28   21   29   29   33                                       
CONECT   29   28   28   30                                            
CONECT   30   29   31   31   65                                       
CONECT   31   30   30   32   66                                       
CONECT   32   33   33   31   67                                       
CONECT   33   28   32   32   68                                       
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   33                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
