COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.448  -1.004  -0.148  1.00  0.00           N  
HETATM    2  C   UNL     1       7.119  -2.076   0.310  1.00  0.00           C  
HETATM    3  O   UNL     1       7.244  -2.239   1.508  1.00  0.00           O  
HETATM    4  N   UNL     1       7.654  -2.972  -0.541  1.00  0.00           N  
HETATM    5  C   UNL     1       7.523  -2.807  -1.872  1.00  0.00           C  
HETATM    6  O   UNL     1       8.007  -3.617  -2.643  1.00  0.00           O  
HETATM    7  C   UNL     1       6.819  -1.683  -2.367  1.00  0.00           C  
HETATM    8  C   UNL     1       6.293  -0.800  -1.492  1.00  0.00           C  
HETATM    9  P   UNL     1       0.564   1.922  -0.568  1.00  0.00           P  
HETATM   10  P   UNL     1      -2.262   1.038  -0.431  1.00  0.00           P  
HETATM   11  C   UNL     1      -4.939  -0.428   0.010  1.00  0.00           C  
HETATM   12  O   UNL     1       0.863   1.862  -2.149  1.00  0.00           O  
HETATM   13  C   UNL     1       5.871  -0.049   0.802  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.560   1.159  -1.875  1.00  0.00           O  
HETATM   15  N   UNL     1      -5.570  -1.380   2.174  1.00  0.00           N  
HETATM   16  O   UNL     1       7.718   1.450   1.409  1.00  0.00           O  
HETATM   17  C   UNL     1      -5.771  -1.494   0.728  1.00  0.00           C  
HETATM   18  O   UNL     1       0.221   3.309  -0.184  1.00  0.00           O  
HETATM   19  C   UNL     1       6.522   1.348   0.635  1.00  0.00           C  
HETATM   20  O   UNL     1      -2.834   2.328   0.345  1.00  0.00           O  
HETATM   21  C   UNL     1      -7.252  -1.283   0.398  1.00  0.00           C  
HETATM   22  O   UNL     1      -7.675  -0.012   0.895  1.00  0.00           O  
HETATM   23  O   UNL     1      -0.668   0.947  -0.218  1.00  0.00           O  
HETATM   24  C   UNL     1       5.422   2.286   1.189  1.00  0.00           C  
HETATM   25  O   UNL     1       5.700   2.633   2.547  1.00  0.00           O  
HETATM   26  C   UNL     1      -7.437  -1.327  -1.122  1.00  0.00           C  
HETATM   27  O   UNL     1      -7.075  -2.621  -1.609  1.00  0.00           O  
HETATM   28  C   UNL     1       4.131   1.449   1.099  1.00  0.00           C  
HETATM   29  O   UNL     1       4.478   0.186   0.505  1.00  0.00           O  
HETATM   30  C   UNL     1      -6.541  -0.267  -1.768  1.00  0.00           C  
HETATM   31  O   UNL     1      -5.182  -0.504  -1.396  1.00  0.00           O  
HETATM   32  C   UNL     1       3.103   2.172   0.227  1.00  0.00           C  
HETATM   33  O   UNL     1       1.871   1.448   0.244  1.00  0.00           O  
HETATM   34  C   UNL     1      -6.967   1.122  -1.288  1.00  0.00           C  
HETATM   35  O   UNL     1      -6.236   2.118  -2.006  1.00  0.00           O  
HETATM   36  C   UNL     1      -4.520  -1.991   2.759  1.00  0.00           C  
HETATM   37  O   UNL     1      -3.742  -2.635   2.088  1.00  0.00           O  
HETATM   38  C   UNL     1      -4.313  -1.873   4.247  1.00  0.00           C  
HETATM   39  S   UNL     1      -3.178  -0.713   0.337  1.00  0.00           S  
HETATM   40  H   UNL     1       6.705  -1.533  -3.431  1.00  0.00           H  
HETATM   41  H   UNL     1       5.752   0.064  -1.851  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.222   0.560   0.375  1.00  0.00           H  
HETATM   43  H   UNL     1       1.096   0.980  -2.472  1.00  0.00           H  
HETATM   44  H   UNL     1       5.990  -0.408   1.825  1.00  0.00           H  
HETATM   45  H   UNL     1       8.162   2.306   1.337  1.00  0.00           H  
HETATM   46  H   UNL     1       6.721   1.560  -0.416  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.674   2.316   1.299  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.845  -2.072   0.861  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.605   0.188   0.721  1.00  0.00           H  
HETATM   50  H   UNL     1       5.342   3.183   0.576  1.00  0.00           H  
HETATM   51  H   UNL     1       6.532   3.111   2.669  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.479  -1.124  -1.368  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.168  -2.720  -2.567  1.00  0.00           H  
HETATM   54  H   UNL     1       3.725   1.287   2.098  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.637  -0.322  -2.852  1.00  0.00           H  
HETATM   56  H   UNL     1       2.939   3.177   0.615  1.00  0.00           H  
HETATM   57  H   UNL     1       3.474   2.234  -0.796  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.034   1.256  -1.466  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.761   1.217  -0.222  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.455   3.026  -1.753  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.106  -1.262   4.677  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.337  -2.866   4.697  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.348  -1.408   4.444  1.00  0.00           H  
HETATM   64  H   UNL     1       8.135  -3.740  -0.194  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.192  -0.865   2.711  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.460  -2.484   0.394  1.00  0.00           H  
CONECT    1   13    8    2                                            
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   64                                            
CONECT    5    4    7    6    6                                       
CONECT    6    5    5                                                 
CONECT    7    5    8    8   40                                       
CONECT    8    1    7    7   41                                       
CONECT    9   18   18   23   12                                       
CONECT    9   33                                                      
CONECT   10   14   14   23   20                                       
CONECT   10   39                                                      
CONECT   11   39   17   31   42                                       
CONECT   12    9   43                                                 
CONECT   13    1   19   29   44                                       
CONECT   14   10   10                                                 
CONECT   15   36   17   65                                            
CONECT   16   19   45                                                 
CONECT   17   11   15   21   66                                       
CONECT   18    9    9                                                 
CONECT   19   13   16   24   46                                       
CONECT   20   10   47                                                 
CONECT   21   17   22   26   48                                       
CONECT   22   21   49                                                 
CONECT   23    9   10                                                 
CONECT   24   19   28   25   50                                       
CONECT   25   24   51                                                 
CONECT   26   21   27   30   52                                       
CONECT   27   26   53                                                 
CONECT   28   24   32   29   54                                       
CONECT   29   13   28                                                 
CONECT   30   26   31   34   55                                       
CONECT   31   11   30                                                 
CONECT   32   28   33   56   57                                       
CONECT   33    9   32                                                 
CONECT   34   30   35   58   59                                       
CONECT   35   34   60                                                 
CONECT   36   15   37   37   38                                       
CONECT   37   36   36                                                 
CONECT   38   36   61   62   63                                       
CONECT   39   10   11                                                 
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   16                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   30                                                      
CONECT   56   32                                                      
CONECT   57   32                                                      
CONECT   58   34                                                      
CONECT   59   34                                                      
CONECT   60   35                                                      
CONECT   61   38                                                      
CONECT   62   38                                                      
CONECT   63   38                                                      
CONECT   64    4                                                      
CONECT   65   15                                                      
CONECT   66   17                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
