COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       0.855  -1.427   0.660  1.00  0.00           C  
HETATM    2  C   UNL     1       1.093  -0.892  -0.593  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.582   0.433  -1.815  1.00  0.00           C  
HETATM    4  C   UNL     1       1.285  -2.710   0.958  1.00  0.00           C  
HETATM    5  C   UNL     1       1.956  -3.457  -0.005  1.00  0.00           C  
HETATM    6  C   UNL     1       2.192  -2.915  -1.258  1.00  0.00           C  
HETATM    7  C   UNL     1       1.760  -1.634  -1.549  1.00  0.00           C  
HETATM    8  C   UNL     1       3.615   2.413   1.299  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.448  -0.710   0.176  1.00  0.00           C  
HETATM   10  C   UNL     1       2.954  -5.469  -0.788  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.064   0.598  -0.055  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.798   0.182  -1.292  1.00  0.00           N  
HETATM   13  N   UNL     1       6.757   4.199   0.772  1.00  0.00           N  
HETATM   14  C   UNL     1       6.848   4.220  -0.551  1.00  0.00           C  
HETATM   15  C   UNL     1       5.900   3.658  -1.348  1.00  0.00           C  
HETATM   16  C   UNL     1       4.788   3.035  -0.745  1.00  0.00           C  
HETATM   17  C   UNL     1       4.709   3.024   0.671  1.00  0.00           C  
HETATM   18  C   UNL     1       5.747   3.636   1.408  1.00  0.00           C  
HETATM   19  C   UNL     1       3.773   2.436  -1.500  1.00  0.00           C  
HETATM   20  C   UNL     1       2.714   1.833  -0.851  1.00  0.00           C  
HETATM   21  C   UNL     1       2.641   1.832   0.547  1.00  0.00           C  
HETATM   22  N   UNL     1       5.705   3.644   2.792  1.00  0.00           N  
HETATM   23  N   UNL     1       1.698   1.234  -1.595  1.00  0.00           N  
HETATM   24  C   UNL     1       0.625   0.504  -0.916  1.00  0.00           C  
HETATM   25  O   UNL     1      -0.459   0.602  -3.010  1.00  0.00           O  
HETATM   26  O   UNL     1       2.380  -4.716   0.283  1.00  0.00           O  
HETATM   27  O   UNL     1       1.051  -3.237   2.190  1.00  0.00           O  
HETATM   28  C   UNL     1       0.357  -2.413   3.128  1.00  0.00           C  
HETATM   29  C   UNL     1       0.188  -3.171   4.446  1.00  0.00           C  
HETATM   30  C   UNL     1       4.441  -5.130  -0.910  1.00  0.00           C  
HETATM   31  C   UNL     1       2.793  -6.964  -0.504  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.972   0.114  -2.166  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.198  -0.177  -1.340  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.939   0.864  -0.813  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.703  -1.751  -0.345  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.575  -1.485  -1.099  1.00  0.00           C  
HETATM   37  S   UNL     1      -7.010   1.925   0.614  1.00  0.00           S  
HETATM   38  O   UNL     1      -6.742   3.059  -0.199  1.00  0.00           O  
HETATM   39  O   UNL     1      -8.319   1.416   0.831  1.00  0.00           O  
HETATM   40  N   UNL     1      -6.387   2.265   2.111  1.00  0.00           N  
HETATM   41  H   UNL     1       0.337  -0.843   1.407  1.00  0.00           H  
HETATM   42  H   UNL     1       2.713  -3.493  -2.007  1.00  0.00           H  
HETATM   43  H   UNL     1       1.944  -1.213  -2.527  1.00  0.00           H  
HETATM   44  H   UNL     1       3.548   2.400   2.377  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.327  -0.918   0.768  1.00  0.00           H  
HETATM   46  H   UNL     1       2.446  -5.220  -1.719  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.897   0.047  -0.337  1.00  0.00           H  
HETATM   48  H   UNL     1       7.701   4.698  -1.010  1.00  0.00           H  
HETATM   49  H   UNL     1       5.997   3.688  -2.423  1.00  0.00           H  
HETATM   50  H   UNL     1       3.821   2.438  -2.579  1.00  0.00           H  
HETATM   51  H   UNL     1       1.801   1.362   1.036  1.00  0.00           H  
HETATM   52  H   UNL     1       4.961   3.229   3.257  1.00  0.00           H  
HETATM   53  H   UNL     1       6.418   4.065   3.296  1.00  0.00           H  
HETATM   54  H   UNL     1       1.702   1.301  -2.563  1.00  0.00           H  
HETATM   55  H   UNL     1       0.361   1.021   0.007  1.00  0.00           H  
HETATM   56  H   UNL     1       0.928  -1.501   3.303  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.624  -2.155   2.729  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.384  -4.082   4.271  1.00  0.00           H  
HETATM   59  H   UNL     1       1.169  -3.428   4.845  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.342  -2.542   5.162  1.00  0.00           H  
HETATM   61  H   UNL     1       4.878  -5.704  -1.727  1.00  0.00           H  
HETATM   62  H   UNL     1       4.555  -4.065  -1.112  1.00  0.00           H  
HETATM   63  H   UNL     1       4.948  -5.379   0.022  1.00  0.00           H  
HETATM   64  H   UNL     1       1.734  -7.205  -0.416  1.00  0.00           H  
HETATM   65  H   UNL     1       3.231  -7.538  -1.321  1.00  0.00           H  
HETATM   66  H   UNL     1       3.301  -7.213   0.428  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.098   1.066  -2.681  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.832  -0.680  -2.900  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.639   1.886  -0.994  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.998  -2.773  -0.157  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.994  -2.299  -1.507  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.634   1.756   2.450  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.774   2.974   2.648  1.00  0.00           H  
CONECT    1    4    4    2   41                                       
CONECT    2    1   24    7    7                                       
CONECT    3   25   25   12   24                                       
CONECT    4   27    1    1    5                                       
CONECT    5    4   26    6    6                                       
CONECT    6    5    5    7   42                                       
CONECT    7    2    2    6   43                                       
CONECT    8   21   17   17   44                                       
CONECT    9   35   11   11   45                                       
CONECT   10   26   30   31   46                                       
CONECT   11    9    9   34   37                                       
CONECT   12   32    3   47                                            
CONECT   13   18   18   14                                            
CONECT   14   15   15   13   48                                       
CONECT   15   16   14   14   49                                       
CONECT   16   19   19   17   15                                       
CONECT   17    8    8   16   18                                       
CONECT   18   17   22   13   13                                       
CONECT   19   20   16   16   50                                       
CONECT   20   23   21   21   19                                       
CONECT   21   20   20    8   51                                       
CONECT   22   18   52   53                                            
CONECT   23   24   20   54                                            
CONECT   24    3   23    2   55                                       
CONECT   25    3    3                                                 
CONECT   26    5   10                                                 
CONECT   27   28    4                                                 
CONECT   28   29   27   56   57                                       
CONECT   29   28   58   59   60                                       
CONECT   30   10   61   62   63                                       
CONECT   31   10   64   65   66                                       
CONECT   32   33   12   67   68                                       
CONECT   33   36   32   34   34                                       
CONECT   34   33   33   11   69                                       
CONECT   35   36   36    9   70                                       
CONECT   36   35   35   33   71                                       
CONECT   37   11   39   39   40                                       
CONECT   37   38   38                                                 
CONECT   38   37   37                                                 
CONECT   39   37   37                                                 
CONECT   40   37   72   73                                            
CONECT   41    1                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   12                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   19                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   30                                                      
CONECT   63   30                                                      
CONECT   64   31                                                      
CONECT   65   31                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   32                                                      
CONECT   69   34                                                      
CONECT   70   35                                                      
CONECT   71   36                                                      
CONECT   72   40                                                      
CONECT   73   40                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
