COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       8.191   1.676   0.642  1.00  0.00           O  
HETATM    2  P   UNL     1       7.984   0.351  -0.249  1.00  0.00           P  
HETATM    3  O   UNL     1       8.821   0.488  -1.617  1.00  0.00           O  
HETATM    4  O   UNL     1       8.462  -0.830   0.505  1.00  0.00           O  
HETATM    5  O   UNL     1       6.421   0.173  -0.591  1.00  0.00           O  
HETATM    6  P   UNL     1       5.138  -0.306   0.256  1.00  0.00           P  
HETATM    7  O   UNL     1       5.151   0.348   1.584  1.00  0.00           O  
HETATM    8  O   UNL     1       5.186  -1.905   0.445  1.00  0.00           O  
HETATM    9  O   UNL     1       3.794   0.101  -0.530  1.00  0.00           O  
HETATM   10  C   UNL     1       2.486  -0.094   0.012  1.00  0.00           C  
HETATM   11  C   UNL     1       1.440   0.400  -0.989  1.00  0.00           C  
HETATM   12  C   UNL     1       0.061   0.194  -0.418  1.00  0.00           C  
HETATM   13  S   UNL     1      -0.938  -1.245  -0.611  1.00  0.00           S  
HETATM   14  C   UNL     1      -0.619   1.069   0.330  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.068   2.420   0.707  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.810   0.653   0.711  1.00  0.00           N1+
HETATM   17  C   UNL     1      -2.172  -0.524   0.327  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.491  -1.172   0.661  1.00  0.00           C  
HETATM   19  O   UNL     1      -4.551  -0.242   0.431  1.00  0.00           O  
HETATM   20  C   UNL     1      -3.494  -1.594   2.132  1.00  0.00           C  
HETATM   21  P   UNL     1      -3.731  -2.640  -0.393  1.00  0.00           P  
HETATM   22  O   UNL     1      -2.471  -3.629  -0.231  1.00  0.00           O  
HETATM   23  O   UNL     1      -5.075  -3.407   0.053  1.00  0.00           O  
HETATM   24  C   UNL     1      -5.594  -4.539  -0.648  1.00  0.00           C  
HETATM   25  O   UNL     1      -3.849  -2.219  -1.806  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.684   1.491   1.536  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.674   2.206   0.653  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.248   3.110  -0.300  1.00  0.00           C  
HETATM   29  N   UNL     1      -4.147   3.721  -1.059  1.00  0.00           N  
HETATM   30  C   UNL     1      -5.434   3.477  -0.917  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.418   4.196  -1.804  1.00  0.00           C  
HETATM   32  N   UNL     1      -5.885   2.622  -0.021  1.00  0.00           N  
HETATM   33  C   UNL     1      -5.044   1.967   0.774  1.00  0.00           C  
HETATM   34  N   UNL     1      -5.521   1.065   1.712  1.00  0.00           N  
HETATM   35  H   UNL     1       7.899   2.490   0.210  1.00  0.00           H  
HETATM   36  H   UNL     1       9.773   0.599  -1.487  1.00  0.00           H  
HETATM   37  H   UNL     1       5.181  -2.399  -0.386  1.00  0.00           H  
HETATM   38  H   UNL     1       2.329  -1.154   0.209  1.00  0.00           H  
HETATM   39  H   UNL     1       2.391   0.467   0.942  1.00  0.00           H  
HETATM   40  H   UNL     1       1.597   1.460  -1.187  1.00  0.00           H  
HETATM   41  H   UNL     1       1.535  -0.161  -1.920  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.347   3.151  -0.052  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.476   2.723   1.671  1.00  0.00           H  
HETATM   44  H   UNL     1       1.019   2.363   0.774  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.681  -0.017  -0.501  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.271  -0.731   2.758  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.475  -1.990   2.395  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.738  -2.363   2.291  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.333  -3.946   0.672  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.507  -4.881  -0.160  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.817  -4.258  -1.678  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.856  -5.340  -0.642  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.220   0.864   2.249  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.082   2.223   2.075  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.196   3.318  -0.425  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.588   3.610  -2.707  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.361   4.324  -1.271  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.018   5.173  -2.074  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.920   0.419   2.112  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.457   1.081   1.967  1.00  0.00           H  
CONECT    1    2   35                                                 
CONECT    2    1    3    4    4                                       
CONECT    2    5                                                      
CONECT    3    2   36                                                 
CONECT    4    2    2                                                 
CONECT    5    2    6                                                 
CONECT    6    5    7    7    8                                       
CONECT    6    9                                                      
CONECT    7    6    6                                                 
CONECT    8    6   37                                                 
CONECT    9    6   10                                                 
CONECT   10    9   11   38   39                                       
CONECT   11   10   12   40   41                                       
CONECT   12   11   13   14   14                                       
CONECT   13   12   17                                                 
CONECT   14   12   12   15   16                                       
CONECT   15   14   42   43   44                                       
CONECT   16   14   17   17   26                                       
CONECT   17   13   16   16   18                                       
CONECT   18   17   19   20   21                                       
CONECT   19   18   45                                                 
CONECT   20   18   46   47   48                                       
CONECT   21   18   22   23   25                                       
CONECT   21   25                                                      
CONECT   22   21   49                                                 
CONECT   23   21   24                                                 
CONECT   24   23   50   51   52                                       
CONECT   25   21   21                                                 
CONECT   26   16   27   53   54                                       
CONECT   27   26   28   28   33                                       
CONECT   28   27   27   29   55                                       
CONECT   29   28   30   30                                            
CONECT   30   29   29   31   32                                       
CONECT   31   30   56   57   58                                       
CONECT   32   30   33   33                                            
CONECT   33   27   32   32   34                                       
CONECT   34   33   59   60                                            
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    8                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   22                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   28                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
CONECT   59   34                                                      
CONECT   60   34                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
