COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.174   4.539   1.883  1.00  0.00           C  
HETATM    2  C   UNL     1       4.606   3.139   1.442  1.00  0.00           C  
HETATM    3  C   UNL     1       5.051   2.333   2.665  1.00  0.00           C  
HETATM    4  C   UNL     1       3.430   2.432   0.766  1.00  0.00           C  
HETATM    5  C   UNL     1       3.895   1.082   0.214  1.00  0.00           C  
HETATM    6  N   UNL     1       4.878   1.302  -0.849  1.00  0.00           N  
HETATM    7  C   UNL     1       4.536   2.003  -1.948  1.00  0.00           C  
HETATM    8  C   UNL     1       5.548   2.229  -3.042  1.00  0.00           C  
HETATM    9  O   UNL     1       3.415   2.452  -2.057  1.00  0.00           O  
HETATM   10  C   UNL     1       2.712   0.333  -0.343  1.00  0.00           C  
HETATM   11  O   UNL     1       2.506   0.326  -1.538  1.00  0.00           O  
HETATM   12  N   UNL     1       1.883  -0.330   0.488  1.00  0.00           N  
HETATM   13  C   UNL     1       0.733  -1.059  -0.054  1.00  0.00           C  
HETATM   14  C   UNL     1       0.645  -2.436   0.607  1.00  0.00           C  
HETATM   15  C   UNL     1       1.868  -3.242   0.252  1.00  0.00           C  
HETATM   16  C   UNL     1       1.913  -3.944  -0.938  1.00  0.00           C  
HETATM   17  C   UNL     1       3.034  -4.683  -1.263  1.00  0.00           C  
HETATM   18  C   UNL     1       4.112  -4.721  -0.398  1.00  0.00           C  
HETATM   19  C   UNL     1       4.068  -4.018   0.792  1.00  0.00           C  
HETATM   20  C   UNL     1       2.948  -3.275   1.115  1.00  0.00           C  
HETATM   21  P   UNL     1      -0.794  -0.123   0.287  1.00  0.00           P  
HETATM   22  O   UNL     1      -0.754   1.167  -0.436  1.00  0.00           O  
HETATM   23  O   UNL     1      -0.914   0.151   1.869  1.00  0.00           O1-
HETATM   24  C   UNL     1      -2.236  -1.089  -0.273  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.505  -0.248  -0.117  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.642  -0.888  -0.915  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.857   0.003  -0.862  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.040   0.978  -1.824  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.154   1.796  -1.776  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.083   1.638  -0.765  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.900   0.662   0.197  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.789  -0.159   0.145  1.00  0.00           C  
HETATM   33  C   UNL     1      -3.888  -0.182   1.339  1.00  0.00           C  
HETATM   34  O   UNL     1      -4.976   0.507   1.716  1.00  0.00           O  
HETATM   35  O   UNL     1      -3.215  -0.749   2.167  1.00  0.00           O  
HETATM   36  H   UNL     1       3.345   4.458   2.587  1.00  0.00           H  
HETATM   37  H   UNL     1       5.012   5.042   2.365  1.00  0.00           H  
HETATM   38  H   UNL     1       3.857   5.113   1.013  1.00  0.00           H  
HETATM   39  H   UNL     1       5.435   3.219   0.739  1.00  0.00           H  
HETATM   40  H   UNL     1       5.358   1.336   2.350  1.00  0.00           H  
HETATM   41  H   UNL     1       5.889   2.837   3.146  1.00  0.00           H  
HETATM   42  H   UNL     1       4.222   2.253   3.368  1.00  0.00           H  
HETATM   43  H   UNL     1       2.635   2.272   1.494  1.00  0.00           H  
HETATM   44  H   UNL     1       3.056   3.049  -0.051  1.00  0.00           H  
HETATM   45  H   UNL     1       4.350   0.500   1.015  1.00  0.00           H  
HETATM   46  H   UNL     1       5.775   0.943  -0.762  1.00  0.00           H  
HETATM   47  H   UNL     1       6.491   1.756  -2.769  1.00  0.00           H  
HETATM   48  H   UNL     1       5.180   1.796  -3.973  1.00  0.00           H  
HETATM   49  H   UNL     1       5.705   3.300  -3.177  1.00  0.00           H  
HETATM   50  H   UNL     1       2.047  -0.325   1.444  1.00  0.00           H  
HETATM   51  H   UNL     1       0.853  -1.179  -1.130  1.00  0.00           H  
HETATM   52  H   UNL     1       0.589  -2.318   1.689  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.246  -2.954   0.251  1.00  0.00           H  
HETATM   54  H   UNL     1       1.071  -3.915  -1.614  1.00  0.00           H  
HETATM   55  H   UNL     1       3.069  -5.232  -2.192  1.00  0.00           H  
HETATM   56  H   UNL     1       4.988  -5.299  -0.652  1.00  0.00           H  
HETATM   57  H   UNL     1       4.910  -4.047   1.468  1.00  0.00           H  
HETATM   58  H   UNL     1       2.915  -2.723   2.042  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.107  -1.360  -1.320  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.323  -1.993   0.329  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.321   0.759  -0.490  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.331  -1.017  -1.952  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.886  -1.860  -0.485  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.314   1.102  -2.614  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.297   2.558  -2.527  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.953   2.277  -0.726  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.626   0.539   0.987  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.646  -0.921   0.897  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.182   0.521   2.661  1.00  0.00           H  
CONECT    1    2   36   37   38                                       
CONECT    2    1    3    4   39                                       
CONECT    3    2   40   41   42                                       
CONECT    4    2    5   43   44                                       
CONECT    5    4   10    6   45                                       
CONECT    6    5    7   46                                            
CONECT    7    6    9    9    8                                       
CONECT    8    7   47   48   49                                       
CONECT    9    7    7                                                 
CONECT   10    5   12   11   11                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   50                                            
CONECT   13   12   14   21   51                                       
CONECT   14   13   15   52   53                                       
CONECT   15   14   16   16   20                                       
CONECT   16   15   15   17   54                                       
CONECT   17   16   18   18   55                                       
CONECT   18   17   17   19   56                                       
CONECT   19   18   20   20   57                                       
CONECT   20   15   19   19   58                                       
CONECT   21   13   24   22   22                                       
CONECT   21   23                                                      
CONECT   22   21   21                                                 
CONECT   23   21                                                      
CONECT   24   21   25   59   60                                       
CONECT   25   24   26   33   61                                       
CONECT   26   25   27   62   63                                       
CONECT   27   26   32   32   28                                       
CONECT   28   27   29   29   64                                       
CONECT   29   28   28   30   65                                       
CONECT   30   29   31   31   66                                       
CONECT   31   30   30   32   67                                       
CONECT   32   27   27   31   68                                       
CONECT   33   25   35   35   34                                       
CONECT   34   33   69                                                 
CONECT   35   33   33                                                 
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    8                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   24                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   28                                                      
CONECT   65   29                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   32                                                      
CONECT   69   34                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
