COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.522  -1.936   0.355  1.00  0.00           C  
HETATM    2  O   UNL     1       8.087  -3.050   0.530  1.00  0.00           O  
HETATM    3  O   UNL     1       9.847  -1.722   0.373  1.00  0.00           O  
HETATM    4  C   UNL     1       7.577  -0.788   0.110  1.00  0.00           C  
HETATM    5  C   UNL     1       6.135  -1.300   0.133  1.00  0.00           C  
HETATM    6  C   UNL     1       5.190  -0.152  -0.112  1.00  0.00           C  
HETATM    7  O   UNL     1       5.627   0.966  -0.288  1.00  0.00           O  
HETATM    8  N   UNL     1       3.860  -0.367  -0.136  1.00  0.00           N  
HETATM    9  C   UNL     1       2.942   0.749  -0.374  1.00  0.00           C  
HETATM   10  C   UNL     1       1.598   0.431   0.229  1.00  0.00           C  
HETATM   11  O   UNL     1       1.160  -0.698   0.174  1.00  0.00           O  
HETATM   12  C   UNL     1       2.785   0.968  -1.880  1.00  0.00           C  
HETATM   13  C   UNL     1       2.235  -0.305  -2.527  1.00  0.00           C  
HETATM   14  C   UNL     1       1.817   2.126  -2.129  1.00  0.00           C  
HETATM   15  N   UNL     1       0.883   1.403   0.831  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.393   1.215   1.537  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.422   0.645   0.595  1.00  0.00           C  
HETATM   18  O   UNL     1      -1.126   0.415  -0.558  1.00  0.00           O  
HETATM   19  C   UNL     1      -0.849   2.602   2.036  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.091   3.576   1.095  1.00  0.00           C  
HETATM   21  C   UNL     1       1.253   2.828   0.894  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.671   0.391   1.034  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.671  -0.162   0.118  1.00  0.00           C  
HETATM   24  P   UNL     1      -4.848   1.146  -0.359  1.00  0.00           P  
HETATM   25  O   UNL     1      -5.608   1.584   0.833  1.00  0.00           O  
HETATM   26  O   UNL     1      -4.041   2.397  -0.970  1.00  0.00           O  
HETATM   27  C   UNL     1      -4.424  -1.298   0.812  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.469  -1.877  -0.144  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.223  -3.013   0.550  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.268  -3.591  -0.407  1.00  0.00           C  
HETATM   31  N   UNL     1      -7.991  -4.682   0.260  1.00  0.00           N  
HETATM   32  H   UNL     1      10.413  -2.490   0.530  1.00  0.00           H  
HETATM   33  H   UNL     1       7.708  -0.037   0.889  1.00  0.00           H  
HETATM   34  H   UNL     1       7.789  -0.344  -0.863  1.00  0.00           H  
HETATM   35  H   UNL     1       6.004  -2.051  -0.646  1.00  0.00           H  
HETATM   36  H   UNL     1       5.923  -1.744   1.105  1.00  0.00           H  
HETATM   37  H   UNL     1       3.511  -1.261   0.004  1.00  0.00           H  
HETATM   38  H   UNL     1       3.342   1.653   0.085  1.00  0.00           H  
HETATM   39  H   UNL     1       3.756   1.206  -2.316  1.00  0.00           H  
HETATM   40  H   UNL     1       1.264  -0.543  -2.091  1.00  0.00           H  
HETATM   41  H   UNL     1       2.123  -0.149  -3.599  1.00  0.00           H  
HETATM   42  H   UNL     1       2.924  -1.130  -2.349  1.00  0.00           H  
HETATM   43  H   UNL     1       2.259   3.054  -1.766  1.00  0.00           H  
HETATM   44  H   UNL     1       1.620   2.212  -3.198  1.00  0.00           H  
HETATM   45  H   UNL     1       0.882   1.938  -1.602  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.252   0.542   2.383  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.927   2.717   1.923  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.550   2.757   3.073  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.620   3.697   0.150  1.00  0.00           H  
HETATM   50  H   UNL     1       0.068   4.540   1.578  1.00  0.00           H  
HETATM   51  H   UNL     1       1.920   3.010   1.737  1.00  0.00           H  
HETATM   52  H   UNL     1       1.724   3.140  -0.038  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.907   0.576   1.957  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.174  -0.547  -0.773  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.605   3.132  -1.246  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.721  -2.080   1.098  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.921  -0.914   1.703  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.173  -1.095  -0.429  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.973  -2.261  -1.035  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.519  -3.795   0.835  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.719  -2.628   1.441  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.971  -2.809  -0.692  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.771  -3.976  -1.298  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.688  -5.081  -0.352  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.353  -5.390   0.591  1.00  0.00           H  
HETATM   66  O   UNL     1      -5.868   0.572  -1.465  1.00  0.00           O  
HETATM   67  H   UNL     1      -5.438   0.266  -2.275  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   32                                                 
CONECT    4    1    5   33   34                                       
CONECT    5    4    6   35   36                                       
CONECT    6    5    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6    9   37                                            
CONECT    9    8   10   12   38                                       
CONECT   10    9   11   11   15                                       
CONECT   11   10   10                                                 
CONECT   12    9   13   14   39                                       
CONECT   13   12   40   41   42                                       
CONECT   14   12   43   44   45                                       
CONECT   15   10   16   21                                            
CONECT   16   15   17   19   46                                       
CONECT   17   16   18   18   22                                       
CONECT   18   17   17                                                 
CONECT   19   16   20   47   48                                       
CONECT   20   19   21   49   50                                       
CONECT   21   15   20   51   52                                       
CONECT   22   17   23   53                                            
CONECT   23   22   24   27   54                                       
CONECT   24   23   25   25   26                                       
CONECT   24   66                                                      
CONECT   25   24   24                                                 
CONECT   26   24   55                                                 
CONECT   27   23   28   56   57                                       
CONECT   28   27   29   58   59                                       
CONECT   29   28   30   60   61                                       
CONECT   30   29   31   62   63                                       
CONECT   31   30   64   65                                            
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   30                                                      
CONECT   63   30                                                      
CONECT   64   31                                                      
CONECT   65   31                                                      
CONECT   66   24   67                                                 
CONECT   67   66                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
