COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.614   0.917  -1.262  1.00  0.00           O  
HETATM    2  C   UNL     1      -6.164   1.656  -0.463  1.00  0.00           C  
HETATM    3  N   UNL     1      -6.644   2.828  -0.877  1.00  0.00           N  
HETATM    4  C   UNL     1      -7.246   3.651  -0.028  1.00  0.00           C  
HETATM    5  N   UNL     1      -7.737   4.858  -0.467  1.00  0.00           N  
HETATM    6  C   UNL     1      -7.375   3.283   1.327  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.887   2.086   1.731  1.00  0.00           C  
HETATM    8  N   UNL     1      -6.276   1.274   0.823  1.00  0.00           N  
HETATM    9  C   UNL     1      -5.738  -0.020   1.248  1.00  0.00           C  
HETATM   10  O   UNL     1      -4.361  -0.153   0.834  1.00  0.00           O  
HETATM   11  C   UNL     1      -6.481  -1.172   0.534  1.00  0.00           C  
HETATM   12  O   UNL     1      -7.492  -1.724   1.379  1.00  0.00           O  
HETATM   13  C   UNL     1      -5.374  -2.216   0.259  1.00  0.00           C  
HETATM   14  O   UNL     1      -5.666  -3.445   0.928  1.00  0.00           O  
HETATM   15  C   UNL     1      -4.096  -1.573   0.843  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.886  -1.895  -0.036  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.710  -1.327   0.547  1.00  0.00           O  
HETATM   18  P   UNL     1      -0.482  -1.703  -0.424  1.00  0.00           P  
HETATM   19  O   UNL     1      -0.782  -1.243  -1.799  1.00  0.00           O  
HETATM   20  O   UNL     1      -0.269  -3.298  -0.427  1.00  0.00           O  
HETATM   21  O   UNL     1       0.858  -0.983   0.103  1.00  0.00           O  
HETATM   22  P   UNL     1       1.883  -0.941  -1.138  1.00  0.00           P  
HETATM   23  O   UNL     1       1.165  -0.506  -2.357  1.00  0.00           O  
HETATM   24  O   UNL     1       2.499  -2.410  -1.374  1.00  0.00           O  
HETATM   25  O   UNL     1       3.073   0.095  -0.818  1.00  0.00           O  
HETATM   26  C   UNL     1       3.878   0.176  -1.995  1.00  0.00           C  
HETATM   27  C   UNL     1       5.034   1.149  -1.756  1.00  0.00           C  
HETATM   28  O   UNL     1       5.910   0.618  -0.727  1.00  0.00           O  
HETATM   29  C   UNL     1       7.002   1.311  -0.348  1.00  0.00           C  
HETATM   30  O   UNL     1       7.254   2.380  -0.869  1.00  0.00           O  
HETATM   31  C   UNL     1       7.891   0.772   0.696  1.00  0.00           C  
HETATM   32  C   UNL     1       7.542  -0.394   1.383  1.00  0.00           C  
HETATM   33  C   UNL     1       8.377  -0.892   2.358  1.00  0.00           C  
HETATM   34  C   UNL     1       9.563  -0.244   2.663  1.00  0.00           C  
HETATM   35  C   UNL     1       9.922   0.908   1.994  1.00  0.00           C  
HETATM   36  C   UNL     1       9.096   1.424   1.003  1.00  0.00           C  
HETATM   37  N   UNL     1       9.455   2.583   0.328  1.00  0.00           N  
HETATM   38  H   UNL     1      -7.644   5.110  -1.399  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.181   5.456   0.155  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.863   3.941   2.030  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.977   1.780   2.763  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.822  -0.128   2.329  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.916  -0.821  -0.402  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.875  -2.473   0.902  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.262  -2.383  -0.812  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.470  -3.799   0.523  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.928  -1.921   1.862  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.768  -2.976  -0.111  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.037  -1.476  -1.030  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.076  -3.556   0.485  1.00  0.00           H  
HETATM   51  H   UNL     1       2.957  -2.655  -0.559  1.00  0.00           H  
HETATM   52  H   UNL     1       4.278  -0.811  -2.230  1.00  0.00           H  
HETATM   53  H   UNL     1       3.271   0.530  -2.828  1.00  0.00           H  
HETATM   54  H   UNL     1       5.597   1.279  -2.680  1.00  0.00           H  
HETATM   55  H   UNL     1       4.637   2.112  -1.434  1.00  0.00           H  
HETATM   56  H   UNL     1       6.618  -0.903   1.150  1.00  0.00           H  
HETATM   57  H   UNL     1       8.106  -1.794   2.888  1.00  0.00           H  
HETATM   58  H   UNL     1      10.211  -0.642   3.430  1.00  0.00           H  
HETATM   59  H   UNL     1      10.848   1.408   2.238  1.00  0.00           H  
HETATM   60  H   UNL     1      10.319   2.991   0.492  1.00  0.00           H  
HETATM   61  H   UNL     1       8.841   2.984  -0.307  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    8                                       
CONECT    3    2    4    4                                            
CONECT    4    3    3    5    6                                       
CONECT    5    4   38   39                                            
CONECT    6    4    7    7   40                                       
CONECT    7    6    6    8   41                                       
CONECT    8    2    7    9                                            
CONECT    9    8   10   11   42                                       
CONECT   10    9   15                                                 
CONECT   11    9   12   13   43                                       
CONECT   12   11   44                                                 
CONECT   13   11   14   15   45                                       
CONECT   14   13   46                                                 
CONECT   15   10   13   16   47                                       
CONECT   16   15   17   48   49                                       
CONECT   17   16   18                                                 
CONECT   18   17   19   19   20                                       
CONECT   18   21                                                      
CONECT   19   18   18                                                 
CONECT   20   18   50                                                 
CONECT   21   18   22                                                 
CONECT   22   21   23   23   24                                       
CONECT   22   25                                                      
CONECT   23   22   22                                                 
CONECT   24   22   51                                                 
CONECT   25   22   26                                                 
CONECT   26   25   27   52   53                                       
CONECT   27   26   28   54   55                                       
CONECT   28   27   29                                                 
CONECT   29   28   30   30   31                                       
CONECT   30   29   29                                                 
CONECT   31   29   32   32   36                                       
CONECT   32   31   31   33   56                                       
CONECT   33   32   34   34   57                                       
CONECT   34   33   33   35   58                                       
CONECT   35   34   36   36   59                                       
CONECT   36   31   35   35   37                                       
CONECT   37   36   60   61                                            
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    9                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   20                                                      
CONECT   51   24                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   32                                                      
CONECT   57   33                                                      
CONECT   58   34                                                      
CONECT   59   35                                                      
CONECT   60   37                                                      
CONECT   61   37                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
