COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.005  -0.903  -1.500  1.00  0.00           C  
HETATM    2  N   UNL     1       2.341  -1.029  -0.636  1.00  0.00           N  
HETATM    3  O   UNL     1       2.831   5.635   0.291  1.00  0.00           O  
HETATM    4  S   UNL     1      -0.529   1.538  -1.013  1.00  0.00           S  
HETATM    5  C   UNL     1      -0.987  -0.038  -1.637  1.00  0.00           C  
HETATM    6  N   UNL     1       3.266   0.896   0.267  1.00  0.00           N  
HETATM    7  O   UNL     1      -6.945   0.671   1.454  1.00  0.00           O  
HETATM    8  S   UNL     1      -7.042  -0.662   0.970  1.00  0.00           S  
HETATM    9  C   UNL     1       1.176  -0.401  -0.907  1.00  0.00           C  
HETATM   10  N   UNL     1       2.086   2.929   0.389  1.00  0.00           N  
HETATM   11  O   UNL     1      -7.905  -0.988  -0.110  1.00  0.00           O  
HETATM   12  C   UNL     1       1.065   0.949  -0.566  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.244  -0.821  -1.194  1.00  0.00           N  
HETATM   14  O   UNL     1       5.570  -5.417   0.856  1.00  0.00           O  
HETATM   15  C   UNL     1       3.342  -0.388  -0.068  1.00  0.00           C  
HETATM   16  N   UNL     1      -5.525  -0.999   0.396  1.00  0.00           N  
HETATM   17  C   UNL     1       2.160   1.590   0.038  1.00  0.00           C  
HETATM   18  C   UNL     1       4.599  -1.126   0.207  1.00  0.00           C  
HETATM   19  C   UNL     1       3.342   3.384   1.002  1.00  0.00           C  
HETATM   20  C   UNL     1       3.195   4.847   1.428  1.00  0.00           C  
HETATM   21  C   UNL     1       1.612   5.220  -0.330  1.00  0.00           C  
HETATM   22  C   UNL     1       1.743   3.760  -0.774  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.327  -0.361  -2.246  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.477  -1.369  -1.774  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.324  -2.000  -0.663  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.344  -0.306   0.933  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.536   0.258  -0.241  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.274  -1.822   2.344  1.00  0.00           C  
HETATM   29  C   UNL     1       5.675  -0.475   0.807  1.00  0.00           C  
HETATM   30  C   UNL     1       6.843  -1.166   1.061  1.00  0.00           C  
HETATM   31  C   UNL     1       6.945  -2.503   0.721  1.00  0.00           C  
HETATM   32  C   UNL     1       5.880  -3.155   0.125  1.00  0.00           C  
HETATM   33  C   UNL     1       4.707  -2.475  -0.128  1.00  0.00           C  
HETATM   34  C   UNL     1       6.000  -4.611  -0.243  1.00  0.00           C  
HETATM   35  H   UNL     1      -0.081  -1.930  -1.821  1.00  0.00           H  
HETATM   36  H   UNL     1       5.620  -6.368   0.689  1.00  0.00           H  
HETATM   37  H   UNL     1       3.563   2.771   1.876  1.00  0.00           H  
HETATM   38  H   UNL     1       4.153   3.294   0.279  1.00  0.00           H  
HETATM   39  H   UNL     1       4.143   5.205   1.831  1.00  0.00           H  
HETATM   40  H   UNL     1       2.421   4.928   2.190  1.00  0.00           H  
HETATM   41  H   UNL     1       0.791   5.312   0.381  1.00  0.00           H  
HETATM   42  H   UNL     1       1.414   5.847  -1.199  1.00  0.00           H  
HETATM   43  H   UNL     1       2.528   3.677  -1.525  1.00  0.00           H  
HETATM   44  H   UNL     1       0.796   3.422  -1.196  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.736   0.531  -2.719  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.207  -1.146  -2.992  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.042  -0.567  -2.251  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.226  -2.127  -2.515  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.805  -2.866  -0.254  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.289  -2.305  -1.067  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.661   0.508   1.584  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.730  -1.010   1.495  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.601   0.679   0.130  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.114   1.037  -0.739  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.259  -1.669   2.786  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.198  -2.845   1.973  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.507  -1.651   3.099  1.00  0.00           H  
HETATM   58  H   UNL     1       5.596   0.570   1.072  1.00  0.00           H  
HETATM   59  H   UNL     1       7.677  -0.662   1.526  1.00  0.00           H  
HETATM   60  H   UNL     1       7.861  -3.040   0.922  1.00  0.00           H  
HETATM   61  H   UNL     1       3.874  -2.986  -0.589  1.00  0.00           H  
HETATM   62  H   UNL     1       7.040  -4.842  -0.477  1.00  0.00           H  
HETATM   63  H   UNL     1       5.377  -4.819  -1.112  1.00  0.00           H  
CONECT    1    5    5    9   35                                       
CONECT    2    9    9   15                                            
CONECT    3   20   21                                                 
CONECT    4    5   12                                                 
CONECT    5    1    1    4   23                                       
CONECT    6   15   15   17                                            
CONECT    7    8    8                                                 
CONECT    8    7    7   11   11                                       
CONECT    8   16   28                                                 
CONECT    9    1    2    2   12                                       
CONECT   10   17   19   22                                            
CONECT   11    8    8                                                 
CONECT   12    4    9   17   17                                       
CONECT   13   23   24   27                                            
CONECT   14   34   36                                                 
CONECT   15    2    6    6   18                                       
CONECT   16    8   25   26                                            
CONECT   17    6   10   12   12                                       
CONECT   18   15   29   29   33                                       
CONECT   19   10   20   37   38                                       
CONECT   20    3   19   39   40                                       
CONECT   21    3   22   41   42                                       
CONECT   22   10   21   43   44                                       
CONECT   23    5   13   45   46                                       
CONECT   24   13   25   47   48                                       
CONECT   25   16   24   49   50                                       
CONECT   26   16   27   51   52                                       
CONECT   27   13   26   53   54                                       
CONECT   28    8   55   56   57                                       
CONECT   29   18   18   30   58                                       
CONECT   30   29   31   31   59                                       
CONECT   31   30   30   32   60                                       
CONECT   32   31   33   33   34                                       
CONECT   33   18   32   32   61                                       
CONECT   34   14   32   62   63                                       
CONECT   35    1                                                      
CONECT   36   14                                                      
CONECT   37   19                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   31                                                      
CONECT   61   33                                                      
CONECT   62   34                                                      
CONECT   63   34                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
