COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.735   1.227   0.191  1.00  0.00           C  
HETATM    2  N   UNL     1       3.394  -1.099   0.488  1.00  0.00           N  
HETATM    3  O   UNL     1       3.007   0.191   2.255  1.00  0.00           O  
HETATM    4  S   UNL     1       1.472   2.913  -1.227  1.00  0.00           S  
HETATM    5  C   UNL     1       3.052   0.080   1.044  1.00  0.00           C  
HETATM    6  N   UNL     1       0.352   0.744   0.015  1.00  0.00           N  
HETATM    7  O   UNL     1      -0.943   2.090  -1.183  1.00  0.00           O  
HETATM    8  C   UNL     1       3.711  -2.247   1.341  1.00  0.00           C  
HETATM    9  N   UNL     1      -3.240   0.870  -0.836  1.00  0.00           N  
HETATM   10  C   UNL     1       4.058  -3.434   0.479  1.00  0.00           C  
HETATM   11  N   UNL     1      -8.547  -1.532  -1.165  1.00  0.00           N  
HETATM   12  C   UNL     1       3.726   2.189  -0.264  1.00  0.00           C  
HETATM   13  C   UNL     1       5.165   2.112   0.085  1.00  0.00           C  
HETATM   14  C   UNL     1       3.200   3.150  -1.033  1.00  0.00           C  
HETATM   15  C   UNL     1       1.476   1.505  -0.267  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.847   1.102  -0.486  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.069   0.275  -0.179  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.453   0.088  -0.558  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.649   0.737  -1.257  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.893  -0.065  -0.973  1.00  0.00           C  
HETATM   21  C   UNL     1       6.133   2.203  -0.914  1.00  0.00           C  
HETATM   22  C   UNL     1       7.470   2.132  -0.583  1.00  0.00           C  
HETATM   23  C   UNL     1       7.852   1.970   0.737  1.00  0.00           C  
HETATM   24  C   UNL     1       6.895   1.879   1.732  1.00  0.00           C  
HETATM   25  C   UNL     1       5.555   1.955   1.414  1.00  0.00           C  
HETATM   26  C   UNL     1       5.369  -3.650   0.097  1.00  0.00           C  
HETATM   27  C   UNL     1       5.688  -4.738  -0.694  1.00  0.00           C  
HETATM   28  C   UNL     1       4.695  -5.610  -1.102  1.00  0.00           C  
HETATM   29  C   UNL     1       3.385  -5.394  -0.719  1.00  0.00           C  
HETATM   30  C   UNL     1       3.067  -4.308   0.075  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.416  -1.028  -1.747  1.00  0.00           C  
HETATM   32  C   UNL     1      -8.785  -0.888   0.029  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.760   0.059   0.202  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.743   0.868   1.339  1.00  0.00           C  
HETATM   35  C   UNL     1      -8.725   0.736   2.280  1.00  0.00           C  
HETATM   36  C   UNL     1      -9.739  -0.197   2.114  1.00  0.00           C  
HETATM   37  C   UNL     1      -9.775  -1.005   0.999  1.00  0.00           C  
HETATM   38  H   UNL     1       3.430  -1.188  -0.477  1.00  0.00           H  
HETATM   39  H   UNL     1       0.429  -0.046   0.572  1.00  0.00           H  
HETATM   40  H   UNL     1       4.559  -2.002   1.980  1.00  0.00           H  
HETATM   41  H   UNL     1       2.847  -2.489   1.961  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.360   1.833  -0.559  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.101  -2.234  -1.539  1.00  0.00           H  
HETATM   44  H   UNL     1       3.761   3.962  -1.471  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.230   0.250   0.899  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.922  -0.740  -0.548  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.322  -0.928  -0.930  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.630   0.062   0.517  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.779   1.754  -0.886  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.471   0.763  -2.332  1.00  0.00           H  
HETATM   51  H   UNL     1       5.836   2.329  -1.945  1.00  0.00           H  
HETATM   52  H   UNL     1       8.222   2.202  -1.356  1.00  0.00           H  
HETATM   53  H   UNL     1       8.900   1.915   0.991  1.00  0.00           H  
HETATM   54  H   UNL     1       7.199   1.752   2.761  1.00  0.00           H  
HETATM   55  H   UNL     1       4.809   1.888   2.192  1.00  0.00           H  
HETATM   56  H   UNL     1       6.144  -2.969   0.416  1.00  0.00           H  
HETATM   57  H   UNL     1       6.711  -4.907  -0.993  1.00  0.00           H  
HETATM   58  H   UNL     1       4.944  -6.460  -1.721  1.00  0.00           H  
HETATM   59  H   UNL     1       2.610  -6.075  -1.038  1.00  0.00           H  
HETATM   60  H   UNL     1       2.044  -4.142   0.378  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.005  -1.357  -2.690  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.957   1.596   1.475  1.00  0.00           H  
HETATM   63  H   UNL     1      -8.711   1.362   3.160  1.00  0.00           H  
HETATM   64  H   UNL     1     -10.508  -0.290   2.867  1.00  0.00           H  
HETATM   65  H   UNL     1     -10.569  -1.728   0.879  1.00  0.00           H  
CONECT    1    5   12   15   15                                       
CONECT    2    5    8   38                                            
CONECT    3    5    5                                                 
CONECT    4   14   15                                                 
CONECT    5    1    2    3    3                                       
CONECT    6   15   16   39                                            
CONECT    7   16   16                                                 
CONECT    8    2   10   40   41                                       
CONECT    9   17   18   42                                            
CONECT   10    8   26   26   30                                       
CONECT   11   31   32   43                                            
CONECT   12    1   13   14   14                                       
CONECT   13   12   21   21   25                                       
CONECT   14    4   12   12   44                                       
CONECT   15    1    1    4    6                                       
CONECT   16    6    7    7   17                                       
CONECT   17    9   16   45   46                                       
CONECT   18    9   19   47   48                                       
CONECT   19   18   20   49   50                                       
CONECT   20   19   31   31   33                                       
CONECT   21   13   13   22   51                                       
CONECT   22   21   23   23   52                                       
CONECT   23   22   22   24   53                                       
CONECT   24   23   25   25   54                                       
CONECT   25   13   24   24   55                                       
CONECT   26   10   10   27   56                                       
CONECT   27   26   28   28   57                                       
CONECT   28   27   27   29   58                                       
CONECT   29   28   30   30   59                                       
CONECT   30   10   29   29   60                                       
CONECT   31   11   20   20   61                                       
CONECT   32   11   33   33   37                                       
CONECT   33   20   32   32   34                                       
CONECT   34   33   35   35   62                                       
CONECT   35   34   34   36   63                                       
CONECT   36   35   37   37   64                                       
CONECT   37   32   36   36   65                                       
CONECT   38    2                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   11                                                      
CONECT   44   14                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   34                                                      
CONECT   63   35                                                      
CONECT   64   36                                                      
CONECT   65   37                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
