COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.439   1.616  -0.564  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.243   0.509  -2.441  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.421   1.942  -1.950  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.060   2.518  -1.543  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.010   2.083   0.625  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.555   3.838   2.177  1.00  0.00           C  
HETATM    7  C   UNL     1       1.149  -0.862   1.703  1.00  0.00           C  
HETATM    8  C   UNL     1       3.285   0.382   1.336  1.00  0.00           C  
HETATM    9  C   UNL     1       2.916  -1.824   0.221  1.00  0.00           C  
HETATM   10  C   UNL     1       4.711   0.064  -1.307  1.00  0.00           C  
HETATM   11  C   UNL     1       5.700   0.368  -2.224  1.00  0.00           C  
HETATM   12  C   UNL     1       7.013   0.018  -1.966  1.00  0.00           C  
HETATM   13  C   UNL     1       6.348  -0.935   0.127  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.783  -0.577   0.313  1.00  0.00           C  
HETATM   15  C   UNL     1       2.191   0.051   2.353  1.00  0.00           C  
HETATM   16  C   UNL     1       3.958  -0.911   0.872  1.00  0.00           C  
HETATM   17  C   UNL     1       1.822  -2.155   1.239  1.00  0.00           C  
HETATM   18  C   UNL     1       5.035  -0.585  -0.130  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.299   0.193  -0.904  1.00  0.00           C  
HETATM   20  C   UNL     1       7.336  -0.637  -0.792  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.734  -3.012   0.326  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.671  -0.353  -1.313  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.576  -0.315  -0.162  1.00  0.00           N  
HETATM   24  O   UNL     1       0.569  -0.197   0.579  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.375  -1.574  -1.211  1.00  0.00           O  
HETATM   26  O   UNL     1      -5.402  -1.132   1.223  1.00  0.00           O  
HETATM   27  O   UNL     1      -0.604   1.311   1.470  1.00  0.00           O  
HETATM   28  O   UNL     1      -1.032   3.406   0.876  1.00  0.00           O  
HETATM   29  S   UNL     1      -4.707  -1.507   0.042  1.00  0.00           S  
HETATM   30  H   UNL     1      -4.208   0.110  -2.753  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.555   0.497  -3.286  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.846   2.550  -2.749  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.090   1.952  -1.090  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.199   3.502  -1.097  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.421   2.600  -2.422  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.626   4.923   2.249  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.164   3.381   2.957  1.00  0.00           H  
HETATM   38  H   UNL     1       0.484   3.533   2.303  1.00  0.00           H  
HETATM   39  H   UNL     1       0.370  -1.098   2.428  1.00  0.00           H  
HETATM   40  H   UNL     1       2.842   0.889   0.478  1.00  0.00           H  
HETATM   41  H   UNL     1       4.027   1.032   1.799  1.00  0.00           H  
HETATM   42  H   UNL     1       2.474  -1.317  -0.636  1.00  0.00           H  
HETATM   43  H   UNL     1       3.396  -2.745  -0.109  1.00  0.00           H  
HETATM   44  H   UNL     1       3.686   0.337  -1.508  1.00  0.00           H  
HETATM   45  H   UNL     1       5.448   0.879  -3.141  1.00  0.00           H  
HETATM   46  H   UNL     1       7.785   0.255  -2.682  1.00  0.00           H  
HETATM   47  H   UNL     1       6.601  -1.441   1.047  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.403  -0.344   1.180  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.827  -1.647   0.112  1.00  0.00           H  
HETATM   50  H   UNL     1       1.711   0.972   2.684  1.00  0.00           H  
HETATM   51  H   UNL     1       2.634  -0.457   3.210  1.00  0.00           H  
HETATM   52  H   UNL     1       4.401  -1.419   1.729  1.00  0.00           H  
HETATM   53  H   UNL     1       2.265  -2.662   2.096  1.00  0.00           H  
HETATM   54  H   UNL     1       1.080  -2.805   0.775  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.600   0.082  -1.733  1.00  0.00           H  
HETATM   56  H   UNL     1       8.361  -0.910  -0.591  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.399  -3.825   0.618  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.209  -3.283  -0.590  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.010  -2.832   1.120  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.565  -1.381  -1.659  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.512   0.408   0.482  1.00  0.00           H  
CONECT    1    5   19    4                                            
CONECT    2   22    3   30   31                                       
CONECT    3    4    2   32   33                                       
CONECT    4    1    3   34   35                                       
CONECT    5   28   27   27    1                                       
CONECT    6   28   36   37   38                                       
CONECT    7   24   17   15   39                                       
CONECT    8   16   15   40   41                                       
CONECT    9   17   16   42   43                                       
CONECT   10   18   18   11   44                                       
CONECT   11   12   12   10   45                                       
CONECT   12   20   11   11   46                                       
CONECT   13   20   20   18   47                                       
CONECT   14   19   24   48   49                                       
CONECT   15    7    8   50   51                                       
CONECT   16    9   18    8   52                                       
CONECT   17    9    7   53   54                                       
CONECT   18   13   16   10   10                                       
CONECT   19    1   22   14   55                                       
CONECT   20   13   13   12   56                                       
CONECT   21   29   57   58   59                                       
CONECT   22   19   23    2   60                                       
CONECT   23   29   22   61                                            
CONECT   24   14    7                                                 
CONECT   25   29   29                                                 
CONECT   26   29   29                                                 
CONECT   27    5    5                                                 
CONECT   28    6    5                                                 
CONECT   29   21   26   26   25                                       
CONECT   29   25   23                                                 
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
