COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.887   0.769  -0.132  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.185   1.286  -0.284  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.263   0.778   0.460  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.511   1.305   0.286  1.00  0.00           C  
HETATM    5  O   UNL     1      -6.553   0.812   1.006  1.00  0.00           O  
HETATM    6  C   UNL     1      -7.834   1.404   0.781  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.731   2.345  -0.623  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.708   2.859  -1.357  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.411   2.340  -1.205  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.331   2.848  -1.947  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.087   2.322  -1.774  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.865   1.290  -0.865  1.00  0.00           C  
HETATM   13  S   UNL     1       0.761   0.639  -0.672  1.00  0.00           S  
HETATM   14  O   UNL     1       0.617  -0.613  -0.014  1.00  0.00           O  
HETATM   15  O   UNL     1       1.404   0.785  -1.931  1.00  0.00           O  
HETATM   16  N   UNL     1       1.564   1.631   0.382  1.00  0.00           N  
HETATM   17  C   UNL     1       2.244   2.831  -0.114  1.00  0.00           C  
HETATM   18  C   UNL     1       3.700   2.521  -0.350  1.00  0.00           C  
HETATM   19  C   UNL     1       4.166   2.000  -1.545  1.00  0.00           C  
HETATM   20  C   UNL     1       5.481   1.785  -1.589  1.00  0.00           C  
HETATM   21  S   UNL     1       6.207   2.254  -0.057  1.00  0.00           S  
HETATM   22  C   UNL     1       4.637   2.735   0.573  1.00  0.00           C  
HETATM   23  C   UNL     1       1.595   1.311   1.811  1.00  0.00           C  
HETATM   24  C   UNL     1       0.512   0.311   2.153  1.00  0.00           C  
HETATM   25  O   UNL     1      -0.664   0.579   2.282  1.00  0.00           O  
HETATM   26  C   UNL     1       2.910   0.583   2.174  1.00  0.00           C  
HETATM   27  C   UNL     1       2.491  -0.900   2.061  1.00  0.00           C  
HETATM   28  N   UNL     1       1.042  -0.916   2.293  1.00  0.00           N  
HETATM   29  C   UNL     1       0.273  -2.115   2.632  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.125  -2.831   1.366  1.00  0.00           C  
HETATM   31  C   UNL     1       0.717  -3.707   0.717  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.322  -2.668   0.795  1.00  0.00           C  
HETATM   33  S   UNL     1      -1.458  -3.614  -0.618  1.00  0.00           S  
HETATM   34  C   UNL     1       0.168  -4.248  -0.408  1.00  0.00           C  
HETATM   35  C   UNL     1       0.830  -5.212  -1.301  1.00  0.00           C  
HETATM   36  N   UNL     1       2.046  -5.615  -1.041  1.00  0.00           N  
HETATM   37  N   UNL     1       0.168  -5.689  -2.414  1.00  0.00           N  
HETATM   38  H   UNL     1      -1.701  -0.034   0.566  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.106  -0.025   1.164  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.790   2.467   1.019  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.115   1.277  -0.265  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.575   0.920   1.417  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.726   2.746  -0.743  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.893   3.662  -2.056  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.488   3.650  -2.653  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.259   2.717  -2.343  1.00  0.00           H  
HETATM   47  H   UNL     1       1.783   3.148  -1.050  1.00  0.00           H  
HETATM   48  H   UNL     1       2.157   3.629   0.623  1.00  0.00           H  
HETATM   49  H   UNL     1       3.513   1.783  -2.378  1.00  0.00           H  
HETATM   50  H   UNL     1       6.018   1.383  -2.435  1.00  0.00           H  
HETATM   51  H   UNL     1       4.459   3.137   1.560  1.00  0.00           H  
HETATM   52  H   UNL     1       1.481   2.216   2.407  1.00  0.00           H  
HETATM   53  H   UNL     1       3.698   0.821   1.459  1.00  0.00           H  
HETATM   54  H   UNL     1       3.222   0.824   3.190  1.00  0.00           H  
HETATM   55  H   UNL     1       2.719  -1.281   1.066  1.00  0.00           H  
HETATM   56  H   UNL     1       3.001  -1.494   2.820  1.00  0.00           H  
HETATM   57  H   UNL     1       0.882  -2.777   3.247  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.623  -1.829   3.183  1.00  0.00           H  
HETATM   59  H   UNL     1       1.712  -3.941   1.064  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.099  -2.022   1.177  1.00  0.00           H  
HETATM   61  H   UNL     1       2.482  -6.250  -1.630  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.734  -5.390  -2.607  1.00  0.00           H  
HETATM   63  H   UNL     1       0.604  -6.324  -3.003  1.00  0.00           H  
CONECT    1   12    2    2   38                                       
CONECT    2    1    1    9    3                                       
CONECT    3    2    4    4   39                                       
CONECT    4    3    3    7    5                                       
CONECT    5    4    6                                                 
CONECT    6    5   40   41   42                                       
CONECT    7    8    8    4   43                                       
CONECT    8    9    7    7   44                                       
CONECT    9   10   10    2    8                                       
CONECT   10   11    9    9   45                                       
CONECT   11   12   12   10   46                                       
CONECT   12   13   11   11    1                                       
CONECT   13   15   15   16   12                                       
CONECT   13   14   14                                                 
CONECT   14   13   13                                                 
CONECT   15   13   13                                                 
CONECT   16   17   23   13                                            
CONECT   17   18   16   47   48                                       
CONECT   18   22   22   17   19                                       
CONECT   19   18   20   20   49                                       
CONECT   20   21   19   19   50                                       
CONECT   21   22   20                                                 
CONECT   22   21   18   18   51                                       
CONECT   23   26   16   24   52                                       
CONECT   24   23   28   25   25                                       
CONECT   25   24   24                                                 
CONECT   26   23   27   53   54                                       
CONECT   27   26   28   55   56                                       
CONECT   28   27   24   29                                            
CONECT   29   28   30   57   58                                       
CONECT   30   29   32   32   31                                       
CONECT   31   30   34   34   59                                       
CONECT   32   30   30   33   60                                       
CONECT   33   32   34                                                 
CONECT   34   33   31   31   35                                       
CONECT   35   34   36   36   37                                       
CONECT   36   35   35   61                                            
CONECT   37   35   62   63                                            
CONECT   38    1                                                      
CONECT   39    3                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   29                                                      
CONECT   58   29                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   36                                                      
CONECT   62   37                                                      
CONECT   63   37                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
