COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.572   0.468   0.258  1.00  0.00           C  
HETATM    2  C   UNL     1       1.966   1.824   0.846  1.00  0.00           C  
HETATM    3  C   UNL     1       3.354   2.187   0.385  1.00  0.00           C  
HETATM    4  C   UNL     1       3.539   2.789  -0.845  1.00  0.00           C  
HETATM    5  C   UNL     1       4.812   3.122  -1.268  1.00  0.00           C  
HETATM    6  C   UNL     1       5.901   2.852  -0.460  1.00  0.00           C  
HETATM    7  C   UNL     1       5.716   2.249   0.771  1.00  0.00           C  
HETATM    8  C   UNL     1       4.442   1.922   1.196  1.00  0.00           C  
HETATM    9  C   UNL     1       2.478  -0.602   0.811  1.00  0.00           C  
HETATM   10  C   UNL     1       4.591  -1.814   0.832  1.00  0.00           C  
HETATM   11  C   UNL     1       5.901  -1.798   0.086  1.00  0.00           C  
HETATM   12  C   UNL     1       6.948  -1.012   0.528  1.00  0.00           C  
HETATM   13  C   UNL     1       6.072  -2.577  -1.048  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.379   2.118  -0.843  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.454   2.601   0.472  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.805   2.437   0.711  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.553   1.601  -0.097  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.950   0.930  -1.145  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.694  -1.941  -0.306  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.460  -2.798  -0.018  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.294  -2.961   1.495  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.632  -4.174  -0.664  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.987  -0.922  -0.100  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.586   1.071  -0.060  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.088   1.335  -0.228  1.00  0.00           C  
HETATM   26  C   UNL     1       8.293  -1.715  -1.205  1.00  0.00           C  
HETATM   27  C   UNL     1       7.294  -2.530  -1.702  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.852   1.934  -0.579  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.599   1.095  -1.384  1.00  0.00           C  
HETATM   30  N   UNL     1      -2.907  -0.265  -0.567  1.00  0.00           N  
HETATM   31  N   UNL     1       3.710  -0.775   0.294  1.00  0.00           N  
HETATM   32  N   UNL     1       8.097  -0.992  -0.119  1.00  0.00           N  
HETATM   33  O   UNL     1      -4.282  -2.150  -0.566  1.00  0.00           O  
HETATM   34  O   UNL     1      -4.694  -0.406   0.743  1.00  0.00           O  
HETATM   35  O   UNL     1       2.097  -1.308   1.721  1.00  0.00           O  
HETATM   36  S   UNL     1      -0.147   0.093   0.701  1.00  0.00           S  
HETATM   37  H   UNL     1       1.668   0.500  -0.827  1.00  0.00           H  
HETATM   38  H   UNL     1       1.261   2.584   0.510  1.00  0.00           H  
HETATM   39  H   UNL     1       1.947   1.767   1.934  1.00  0.00           H  
HETATM   40  H   UNL     1       2.688   3.000  -1.476  1.00  0.00           H  
HETATM   41  H   UNL     1       4.957   3.592  -2.229  1.00  0.00           H  
HETATM   42  H   UNL     1       6.896   3.112  -0.790  1.00  0.00           H  
HETATM   43  H   UNL     1       6.567   2.038   1.402  1.00  0.00           H  
HETATM   44  H   UNL     1       4.298   1.451   2.157  1.00  0.00           H  
HETATM   45  H   UNL     1       4.117  -2.789   0.713  1.00  0.00           H  
HETATM   46  H   UNL     1       4.773  -1.625   1.890  1.00  0.00           H  
HETATM   47  H   UNL     1       6.824  -0.406   1.413  1.00  0.00           H  
HETATM   48  H   UNL     1       5.273  -3.205  -1.414  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.075   3.116  -0.527  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.184   2.000  -1.909  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.869   3.254   1.103  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.277   2.961   1.529  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.609   1.472   0.090  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.534   0.275  -1.773  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.812  -1.825  -1.384  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.578  -2.428   0.105  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.571  -0.961   0.154  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.179  -3.448   1.906  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.415  -3.572   1.700  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.172  -1.981   1.955  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.749  -4.058  -1.741  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.752  -4.785  -0.458  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.516  -4.661  -0.252  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.849   1.132   0.997  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.825   1.274  -1.284  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.849   2.329   0.149  1.00  0.00           H  
HETATM   67  H   UNL     1       9.248  -1.674  -1.708  1.00  0.00           H  
HETATM   68  H   UNL     1       7.462  -3.120  -2.591  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.127   0.571  -2.202  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.342  -0.677  -1.239  1.00  0.00           H  
HETATM   71  H   UNL     1       4.015  -0.210  -0.434  1.00  0.00           H  
CONECT    1   36    9    2   37                                       
CONECT    2    3    1   38   39                                       
CONECT    3    8    2    4    4                                       
CONECT    4    3    3    5   40                                       
CONECT    5    6    6    4   41                                       
CONECT    6    7    5    5   42                                       
CONECT    7    8    8    6   43                                       
CONECT    8    7    7    3   44                                       
CONECT    9   31   35   35    1                                       
CONECT   10   11   31   45   46                                       
CONECT   11   13   13   12   10                                       
CONECT   12   32   32   11   47                                       
CONECT   13   27   11   11   48                                       
CONECT   14   28   24   49   50                                       
CONECT   15   28   28   16   51                                       
CONECT   16   17   17   15   52                                       
CONECT   17   18   16   16   53                                       
CONECT   18   29   29   17   54                                       
CONECT   19   20   55   56   57                                       
CONECT   20   22   21   19   33                                       
CONECT   21   20   58   59   60                                       
CONECT   22   20   61   62   63                                       
CONECT   23   33   30   34   34                                       
CONECT   24   30   14   25   64                                       
CONECT   25   24   36   65   66                                       
CONECT   26   27   27   32   67                                       
CONECT   27   26   26   13   68                                       
CONECT   28   29   15   15   14                                       
CONECT   29   18   18   28   69                                       
CONECT   30   23   24   70                                            
CONECT   31   10    9   71                                            
CONECT   32   26   12   12                                            
CONECT   33   20   23                                                 
CONECT   34   23   23                                                 
CONECT   35    9    9                                                 
CONECT   36   25    1                                                 
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   21                                                      
CONECT   61   22                                                      
CONECT   62   22                                                      
CONECT   63   22                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   25                                                      
CONECT   67   26                                                      
CONECT   68   27                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   31                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
