COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.323   3.675   0.125  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.384   0.301   0.005  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.721   0.665  -0.053  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.089   2.016  -0.051  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.100   3.000   0.011  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.774   2.641   0.065  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.408   1.290   0.064  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.257   5.028   0.537  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.414   5.321  -0.323  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.536   4.442   0.021  1.00  0.00           C  
HETATM   11  N   UNL     1      -4.475   2.119  -0.115  1.00  0.00           N  
HETATM   12  C   UNL     1      -5.058   0.909  -0.160  1.00  0.00           C  
HETATM   13  O   UNL     1      -6.253   0.691  -0.220  1.00  0.00           O  
HETATM   14  C   UNL     1      -3.982  -0.114  -0.124  1.00  0.00           C  
HETATM   15  N   UNL     1      -4.115  -1.409  -0.149  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.802   6.734  -0.221  1.00  0.00           C  
HETATM   17  C   UNL     1       2.795  -0.376   1.113  1.00  0.00           C  
HETATM   18  C   UNL     1       1.460  -0.028   1.059  1.00  0.00           C  
HETATM   19  C   UNL     1       1.025   0.912   0.126  1.00  0.00           C  
HETATM   20  C   UNL     1       1.941   1.494  -0.748  1.00  0.00           C  
HETATM   21  C   UNL     1       3.273   1.138  -0.686  1.00  0.00           C  
HETATM   22  C   UNL     1       3.699   0.205   0.242  1.00  0.00           C  
HETATM   23  S   UNL     1       5.448  -0.257   0.319  1.00  0.00           S  
HETATM   24  N   UNL     1       7.138  -0.703   0.392  1.00  0.00           N  
HETATM   25  O   UNL     1       5.779   0.791  -0.926  1.00  0.00           O  
HETATM   26  O   UNL     1       5.046  -1.834  -0.009  1.00  0.00           O  
HETATM   27  C   UNL     1       7.374  -1.702   1.443  1.00  0.00           C  
HETATM   28  C   UNL     1       7.612  -1.187  -0.911  1.00  0.00           C  
HETATM   29  O   UNL     1      -2.969  -2.240  -0.106  1.00  0.00           O  
HETATM   30  C   UNL     1      -3.263  -3.638  -0.141  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.062  -4.398  -0.705  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.843  -3.995  -2.165  1.00  0.00           C  
HETATM   33  O   UNL     1      -0.720  -4.705  -2.692  1.00  0.00           O  
HETATM   34  C   UNL     1      -3.555  -4.124   1.256  1.00  0.00           C  
HETATM   35  O   UNL     1      -3.859  -5.414   1.467  1.00  0.00           O  
HETATM   36  O   UNL     1      -3.514  -3.353   2.185  1.00  0.00           O  
HETATM   37  H   UNL     1       1.072   3.365   0.854  1.00  0.00           H  
HETATM   38  H   UNL     1       0.790   3.765  -0.856  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.103  -0.742   0.006  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.575   4.989   1.579  1.00  0.00           H  
HETATM   41  H   UNL     1       0.498   5.804   0.411  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.338   4.580  -0.705  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.903   4.700   1.014  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.959   2.959  -0.126  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.947   7.364  -0.464  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.615   6.939  -0.918  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.134   6.947   0.796  1.00  0.00           H  
HETATM   48  H   UNL     1       3.134  -1.101   1.838  1.00  0.00           H  
HETATM   49  H   UNL     1       0.755  -0.482   1.739  1.00  0.00           H  
HETATM   50  H   UNL     1       1.609   2.222  -1.473  1.00  0.00           H  
HETATM   51  H   UNL     1       3.983   1.588  -1.363  1.00  0.00           H  
HETATM   52  H   UNL     1       6.002   1.686  -0.638  1.00  0.00           H  
HETATM   53  H   UNL     1       4.871  -2.366   0.779  1.00  0.00           H  
HETATM   54  H   UNL     1       6.785  -2.595   1.233  1.00  0.00           H  
HETATM   55  H   UNL     1       8.432  -1.962   1.467  1.00  0.00           H  
HETATM   56  H   UNL     1       7.078  -1.291   2.408  1.00  0.00           H  
HETATM   57  H   UNL     1       7.490  -0.402  -1.657  1.00  0.00           H  
HETATM   58  H   UNL     1       8.666  -1.457  -0.837  1.00  0.00           H  
HETATM   59  H   UNL     1       7.032  -2.062  -1.206  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.133  -3.811  -0.774  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.172  -4.155  -0.124  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.251  -5.470  -0.649  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.732  -4.238  -2.746  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.654  -2.923  -2.221  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.523  -4.498  -3.616  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.037  -5.679   2.380  1.00  0.00           H  
CONECT    1    6    8   37   38                                       
CONECT    2    3    3    7   39                                       
CONECT    3    2    2    4   14                                       
CONECT    4    3    5    5   11                                       
CONECT    5    4    4    6   10                                       
CONECT    6    1    5    7    7                                       
CONECT    7    2    6    6   19                                       
CONECT    8    1    9   40   41                                       
CONECT    9    8   10   16                                            
CONECT   10    5    9   42   43                                       
CONECT   11    4   12   44                                            
CONECT   12   11   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14    3   12   15   15                                       
CONECT   15   14   14   29                                            
CONECT   16    9   45   46   47                                       
CONECT   17   18   22   22   48                                       
CONECT   18   17   19   19   49                                       
CONECT   19    7   18   18   20                                       
CONECT   20   19   21   21   50                                       
CONECT   21   20   20   22   51                                       
CONECT   22   17   17   21   23                                       
CONECT   23   22   24   25   26                                       
CONECT   24   23   27   28                                            
CONECT   25   23   52                                                 
CONECT   26   23   53                                                 
CONECT   27   24   54   55   56                                       
CONECT   28   24   57   58   59                                       
CONECT   29   15   30                                                 
CONECT   30   29   31   34   60                                       
CONECT   31   30   32   61   62                                       
CONECT   32   31   33   63   64                                       
CONECT   33   32   65                                                 
CONECT   34   30   35   36   36                                       
CONECT   35   34   66                                                 
CONECT   36   34   34                                                 
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   32                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
CONECT   66   35                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
