COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.332   1.927  -0.197  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.877   0.206  -0.262  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.245  -1.910  -0.056  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.112  -3.084   0.695  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.428  -1.811   1.188  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.094  -4.092   0.556  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.192  -2.712  -1.005  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.551   1.299   0.601  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.645   2.535   0.332  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.931   1.629   0.015  1.00  0.00           C  
HETATM   11  O   UNL     1       1.484   1.701   2.209  1.00  0.00           O  
HETATM   12  P   UNL     1       1.499   2.163   0.803  1.00  0.00           P  
HETATM   13  O   UNL     1       1.816   3.741   0.760  1.00  0.00           O  
HETATM   14  O   UNL     1       2.636   1.366  -0.012  1.00  0.00           O  
HETATM   15  C   UNL     1       4.004   1.325   0.398  1.00  0.00           C  
HETATM   16  C   UNL     1       4.916   1.888  -0.709  1.00  0.00           C  
HETATM   17  C   UNL     1       5.683   3.103  -0.184  1.00  0.00           C  
HETATM   18  O   UNL     1       6.436   3.688  -1.248  1.00  0.00           O  
HETATM   19  O   UNL     1       5.837   0.846  -1.075  1.00  0.00           O  
HETATM   20  C   UNL     1       5.191  -0.410  -0.778  1.00  0.00           C  
HETATM   21  N   UNL     1       6.183  -1.479  -0.634  1.00  0.00           N  
HETATM   22  C   UNL     1       6.059  -2.623  -1.373  1.00  0.00           C  
HETATM   23  C   UNL     1       6.974  -3.607  -1.240  1.00  0.00           C  
HETATM   24  C   UNL     1       8.047  -3.433  -0.333  1.00  0.00           C  
HETATM   25  O   UNL     1       8.884  -4.306  -0.197  1.00  0.00           O  
HETATM   26  N   UNL     1       8.134  -2.290   0.377  1.00  0.00           N  
HETATM   27  C   UNL     1       7.210  -1.323   0.221  1.00  0.00           C  
HETATM   28  O   UNL     1       7.301  -0.297   0.868  1.00  0.00           O  
HETATM   29  C   UNL     1       4.475  -0.140   0.570  1.00  0.00           C  
HETATM   30  O   UNL     1       3.360  -1.017   0.740  1.00  0.00           O  
HETATM   31  O   UNL     1       0.062   1.885   0.132  1.00  0.00           O  
HETATM   32  C   UNL     1      -1.163   2.368   0.687  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.345   3.274  -0.834  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.849   3.068  -0.532  1.00  0.00           C  
HETATM   35  O   UNL     1      -6.621   3.194  -1.728  1.00  0.00           O  
HETATM   36  O   UNL     1      -6.294   4.004   0.453  1.00  0.00           O  
HETATM   37  O   UNL     1      -2.469   0.498  -0.147  1.00  0.00           O  
HETATM   38  N   UNL     1      -4.173  -1.126   0.273  1.00  0.00           N  
HETATM   39  N   UNL     1      -3.982  -2.962   1.435  1.00  0.00           N  
HETATM   40  N   UNL     1      -6.285  -1.769  -0.885  1.00  0.00           N  
HETATM   41  N   UNL     1      -8.244  -2.520  -1.865  1.00  0.00           N  
HETATM   42  N   UNL     1      -7.119  -3.875  -0.298  1.00  0.00           N  
HETATM   43  O   UNL     1      -6.018  -5.130   1.191  1.00  0.00           O  
HETATM   44  H   UNL     1      -2.160   2.247  -1.224  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.200   0.281  -1.300  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.515  -1.452   1.640  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.592   1.032   1.657  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.499   3.158   1.214  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.168   0.936  -0.793  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.691   1.568   0.794  1.00  0.00           H  
HETATM   51  H   UNL     1       1.841   4.113  -0.132  1.00  0.00           H  
HETATM   52  H   UNL     1       4.140   1.883   1.325  1.00  0.00           H  
HETATM   53  H   UNL     1       4.317   2.173  -1.574  1.00  0.00           H  
HETATM   54  H   UNL     1       4.977   3.837   0.207  1.00  0.00           H  
HETATM   55  H   UNL     1       6.359   2.790   0.611  1.00  0.00           H  
HETATM   56  H   UNL     1       6.948   4.465  -0.987  1.00  0.00           H  
HETATM   57  H   UNL     1       4.467  -0.663  -1.553  1.00  0.00           H  
HETATM   58  H   UNL     1       5.234  -2.739  -2.060  1.00  0.00           H  
HETATM   59  H   UNL     1       6.888  -4.516  -1.818  1.00  0.00           H  
HETATM   60  H   UNL     1       8.866  -2.163   1.000  1.00  0.00           H  
HETATM   61  H   UNL     1       5.170  -0.229   1.404  1.00  0.00           H  
HETATM   62  H   UNL     1       3.597  -1.954   0.762  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.135   3.457   0.735  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.292   1.963   1.690  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.093   4.334  -0.825  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.078   2.824  -1.790  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.564   3.017  -1.608  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.214   3.882   0.723  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.922  -3.207  -1.963  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.310  -1.698  -2.375  1.00  0.00           H  
HETATM   71  H   UNL     1      -7.806  -4.552  -0.409  1.00  0.00           H  
CONECT    1    9   37   32   44                                       
CONECT    2    8   38   37   45                                       
CONECT    3   40   38    4    4                                       
CONECT    4    3    3    6   39                                       
CONECT    5   38   39   39   46                                       
CONECT    6   42    4   43   43                                       
CONECT    7   41   40   40   42                                       
CONECT    8   10    9    2   47                                       
CONECT    9   33    8    1   48                                       
CONECT   10   34    8   49   50                                       
CONECT   11   12   12                                                 
CONECT   12   14   31   11   11                                       
CONECT   12   13                                                      
CONECT   13   12   51                                                 
CONECT   14   15   12                                                 
CONECT   15   29   16   14   52                                       
CONECT   16   19   15   17   53                                       
CONECT   17   18   16   54   55                                       
CONECT   18   17   56                                                 
CONECT   19   20   16                                                 
CONECT   20   21   29   19   57                                       
CONECT   21   22   27   20                                            
CONECT   22   23   23   21   58                                       
CONECT   23   24   22   22   59                                       
CONECT   24   25   25   23   26                                       
CONECT   25   24   24                                                 
CONECT   26   24   27   60                                            
CONECT   27   26   21   28   28                                       
CONECT   28   27   27                                                 
CONECT   29   30   20   15   61                                       
CONECT   30   29   62                                                 
CONECT   31   32   12                                                 
CONECT   32    1   31   63   64                                       
CONECT   33   34    9   65   66                                       
CONECT   34   36   35   10   33                                       
CONECT   35   34   67                                                 
CONECT   36   34   68                                                 
CONECT   37    2    1                                                 
CONECT   38    2    3    5                                            
CONECT   39    4    5    5                                            
CONECT   40    7    7    3                                            
CONECT   41    7   69   70                                            
CONECT   42    7    6   71                                            
CONECT   43    6    6                                                 
CONECT   44    1                                                      
CONECT   45    2                                                      
CONECT   46    5                                                      
CONECT   47    8                                                      
CONECT   48    9                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
CONECT   51   13                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   20                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   26                                                      
CONECT   61   29                                                      
CONECT   62   30                                                      
CONECT   63   32                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
CONECT   66   33                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   41                                                      
CONECT   70   41                                                      
CONECT   71   42                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
