COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.027  -2.905  -1.453  1.00  0.00           O  
HETATM    2  P   UNL     1      -5.661  -1.871  -0.394  1.00  0.00           P  
HETATM    3  O   UNL     1      -6.059  -0.630  -1.095  1.00  0.00           O  
HETATM    4  O   UNL     1      -6.954  -2.536   0.297  1.00  0.00           O  
HETATM    5  P   UNL     1      -8.462  -2.820  -0.191  1.00  0.00           P  
HETATM    6  O   UNL     1      -9.290  -1.439  -0.203  1.00  0.00           O  
HETATM    7  O   UNL     1      -8.439  -3.394  -1.555  1.00  0.00           O  
HETATM    8  O   UNL     1      -9.165  -3.859   0.817  1.00  0.00           O  
HETATM    9  O   UNL     1      -4.568  -1.523   0.735  1.00  0.00           O  
HETATM   10  C   UNL     1      -3.351  -0.828   0.453  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.547  -0.663   1.744  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.264   0.070   1.447  1.00  0.00           C  
HETATM   13  S   UNL     1       0.268  -0.668   0.987  1.00  0.00           S  
HETATM   14  C   UNL     1       0.994   0.877   0.892  1.00  0.00           C  
HETATM   15  C   UNL     1       2.431   1.134   0.521  1.00  0.00           C  
HETATM   16  O   UNL     1       3.049   1.931   1.533  1.00  0.00           O  
HETATM   17  C   UNL     1       2.489   1.874  -0.817  1.00  0.00           C  
HETATM   18  O   UNL     1       1.821   1.103  -1.817  1.00  0.00           O  
HETATM   19  C   UNL     1       3.172  -0.199   0.398  1.00  0.00           C  
HETATM   20  O   UNL     1       2.632  -0.946  -0.694  1.00  0.00           O  
HETATM   21  C   UNL     1       4.659   0.064   0.150  1.00  0.00           C  
HETATM   22  O   UNL     1       4.824   0.701  -1.119  1.00  0.00           O  
HETATM   23  C   UNL     1       5.420  -1.262   0.158  1.00  0.00           C  
HETATM   24  O   UNL     1       5.255  -1.899   1.427  1.00  0.00           O  
HETATM   25  C   UNL     1       6.907  -0.999  -0.090  1.00  0.00           C  
HETATM   26  O   UNL     1       7.600  -2.244  -0.198  1.00  0.00           O  
HETATM   27  P   UNL     1       9.185  -2.345  -0.461  1.00  0.00           P  
HETATM   28  O   UNL     1       9.533  -1.584  -1.682  1.00  0.00           O  
HETATM   29  O   UNL     1       9.978  -1.731   0.798  1.00  0.00           O  
HETATM   30  O   UNL     1       9.599  -3.889  -0.655  1.00  0.00           O  
HETATM   31  N   UNL     1       0.131   1.792   1.183  1.00  0.00           N1+
HETATM   32  C   UNL     1      -1.090   1.394   1.479  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.197   2.354   1.830  1.00  0.00           C  
HETATM   34  C   UNL     1       0.492   3.212   1.178  1.00  0.00           C  
HETATM   35  C   UNL     1      -0.378   3.948   0.193  1.00  0.00           C  
HETATM   36  C   UNL     1      -1.365   4.833   0.632  1.00  0.00           C  
HETATM   37  N   UNL     1      -1.563   5.051   1.985  1.00  0.00           N  
HETATM   38  N   UNL     1      -2.112   5.463  -0.271  1.00  0.00           N  
HETATM   39  C   UNL     1      -1.926   5.258  -1.559  1.00  0.00           C  
HETATM   40  C   UNL     1      -2.793   5.992  -2.549  1.00  0.00           C  
HETATM   41  N   UNL     1      -1.003   4.430  -2.005  1.00  0.00           N  
HETATM   42  C   UNL     1      -0.217   3.769  -1.167  1.00  0.00           C  
HETATM   43  H   UNL     1      -4.743  -3.743  -1.063  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.346  -1.007   0.660  1.00  0.00           H  
HETATM   45  H   UNL     1     -10.078  -4.077   0.584  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.767  -1.398  -0.269  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.581   0.154   0.040  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.132  -0.093   2.466  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.317  -1.645   2.157  1.00  0.00           H  
HETATM   50  H   UNL     1       3.049   1.523   2.410  1.00  0.00           H  
HETATM   51  H   UNL     1       1.999   2.843  -0.717  1.00  0.00           H  
HETATM   52  H   UNL     1       3.529   2.022  -1.106  1.00  0.00           H  
HETATM   53  H   UNL     1       1.818   1.512  -2.693  1.00  0.00           H  
HETATM   54  H   UNL     1       3.053  -0.767   1.321  1.00  0.00           H  
HETATM   55  H   UNL     1       2.823  -0.566  -1.562  1.00  0.00           H  
HETATM   56  H   UNL     1       5.049   0.712   0.935  1.00  0.00           H  
HETATM   57  H   UNL     1       4.498   0.180  -1.865  1.00  0.00           H  
HETATM   58  H   UNL     1       5.030  -1.910  -0.627  1.00  0.00           H  
HETATM   59  H   UNL     1       5.581  -1.378   2.174  1.00  0.00           H  
HETATM   60  H   UNL     1       7.026  -0.435  -1.015  1.00  0.00           H  
HETATM   61  H   UNL     1       7.318  -0.425   0.741  1.00  0.00           H  
HETATM   62  H   UNL     1       9.798  -2.182   1.635  1.00  0.00           H  
HETATM   63  H   UNL     1      10.543  -4.025  -0.818  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.111   2.640   2.879  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.120   3.243   1.204  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.161   1.874   1.663  1.00  0.00           H  
HETATM   67  H   UNL     1       0.345   3.628   2.174  1.00  0.00           H  
HETATM   68  H   UNL     1       1.538   3.320   0.890  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.929   4.701   2.631  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.335   5.555   2.288  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.322   6.939  -2.813  1.00  0.00           H  
HETATM   72  H   UNL     1      -2.914   5.384  -3.446  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.770   6.183  -2.106  1.00  0.00           H  
HETATM   74  H   UNL     1       0.537   3.093  -1.544  1.00  0.00           H  
CONECT    1    2   43                                                 
CONECT    2    3    3    9    1                                       
CONECT    2    4                                                      
CONECT    3    2    2                                                 
CONECT    4    2    5                                                 
CONECT    5    7    7    4    8                                       
CONECT    5    6                                                      
CONECT    6    5   44                                                 
CONECT    7    5    5                                                 
CONECT    8    5   45                                                 
CONECT    9    2   10                                                 
CONECT   10    9   11   46   47                                       
CONECT   11   10   12   48   49                                       
CONECT   12   11   32   32   13                                       
CONECT   13   12   14                                                 
CONECT   14   13   31   31   15                                       
CONECT   15   14   19   17   16                                       
CONECT   16   15   50                                                 
CONECT   17   15   18   51   52                                       
CONECT   18   17   53                                                 
CONECT   19   20   15   21   54                                       
CONECT   20   19   55                                                 
CONECT   21   19   23   22   56                                       
CONECT   22   21   57                                                 
CONECT   23   24   21   25   58                                       
CONECT   24   23   59                                                 
CONECT   25   23   26   60   61                                       
CONECT   26   25   27                                                 
CONECT   27   28   28   26   30                                       
CONECT   27   29                                                      
CONECT   28   27   27                                                 
CONECT   29   27   62                                                 
CONECT   30   27   63                                                 
CONECT   31   32   34   14   14                                       
CONECT   32   33   12   12   31                                       
CONECT   33   32   64   65   66                                       
CONECT   34   31   35   67   68                                       
CONECT   35   42   34   36   36                                       
CONECT   36   35   35   38   37                                       
CONECT   37   36   69   70                                            
CONECT   38   39   39   36                                            
CONECT   39   41   40   38   38                                       
CONECT   40   39   71   72   73                                       
CONECT   41   42   42   39                                            
CONECT   42   41   41   35   74                                       
CONECT   43    1                                                      
CONECT   44    6                                                      
CONECT   45    8                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   25                                                      
CONECT   62   29                                                      
CONECT   63   30                                                      
CONECT   64   33                                                      
CONECT   65   33                                                      
CONECT   66   33                                                      
CONECT   67   34                                                      
CONECT   68   34                                                      
CONECT   69   37                                                      
CONECT   70   37                                                      
CONECT   71   40                                                      
CONECT   72   40                                                      
CONECT   73   40                                                      
CONECT   74   42                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
