COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.497  -1.736   0.681  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.481  -0.696   0.304  1.00  0.00           C  
HETATM    3  N   UNL     1      -4.176  -0.614   0.512  1.00  0.00           N  
HETATM    4  N   UNL     1      -2.184  -1.789   0.584  1.00  0.00           N  
HETATM    5  C   UNL     1      -3.557   0.528   0.229  1.00  0.00           C  
HETATM    6  O   UNL     1       3.058  -3.644  -1.259  1.00  0.00           O  
HETATM    7  C   UNL     1       2.697  -2.262  -1.211  1.00  0.00           C  
HETATM    8  C   UNL     1       1.164  -2.106  -1.102  1.00  0.00           C  
HETATM    9  O   UNL     1       0.531  -3.387  -1.079  1.00  0.00           O  
HETATM   10  C   UNL     1       3.235  -1.608   0.081  1.00  0.00           C  
HETATM   11  C   UNL     1       4.538  -0.859  -0.204  1.00  0.00           C  
HETATM   12  O   UNL     1       5.078  -0.360   1.021  1.00  0.00           O  
HETATM   13  C   UNL     1       6.303   0.359   0.867  1.00  0.00           C  
HETATM   14  P   UNL     1       5.956   2.006   0.164  1.00  0.00           P  
HETATM   15  O   UNL     1       5.058   2.751   1.074  1.00  0.00           O  
HETATM   16  O   UNL     1       7.336   2.816  -0.010  1.00  0.00           O  
HETATM   17  O   UNL     1       5.247   1.838  -1.272  1.00  0.00           O  
HETATM   18  O   UNL     1       2.201  -0.683   0.483  1.00  0.00           O  
HETATM   19  C   UNL     1       0.956  -1.375   0.243  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.148  -0.418   0.138  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.039   0.912  -0.142  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.219   1.460  -0.159  1.00  0.00           N  
HETATM   23  C   UNL     1      -2.157   0.520   0.111  1.00  0.00           C  
HETATM   24 CL   UNL     1      -4.368  -3.192   1.050  1.00  0.00          Cl  
HETATM   25  N   UNL     1      -4.276   1.697   0.054  1.00  0.00           N  
HETATM   26  C   UNL     1      -5.736   1.686   0.180  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.242   3.087   0.566  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.178   3.546  -0.572  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.653   2.226  -1.229  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.381   1.342  -1.178  1.00  0.00           C  
HETATM   31  H   UNL     1       2.695  -4.119  -2.020  1.00  0.00           H  
HETATM   32  H   UNL     1       3.073  -1.740  -2.091  1.00  0.00           H  
HETATM   33  H   UNL     1       0.782  -1.506  -1.928  1.00  0.00           H  
HETATM   34  H   UNL     1       0.680  -3.913  -1.876  1.00  0.00           H  
HETATM   35  H   UNL     1       3.390  -2.362   0.852  1.00  0.00           H  
HETATM   36  H   UNL     1       5.254  -1.538  -0.667  1.00  0.00           H  
HETATM   37  H   UNL     1       4.339  -0.026  -0.879  1.00  0.00           H  
HETATM   38  H   UNL     1       6.783   0.473   1.839  1.00  0.00           H  
HETATM   39  H   UNL     1       6.965  -0.189   0.196  1.00  0.00           H  
HETATM   40  H   UNL     1       7.227   3.703  -0.380  1.00  0.00           H  
HETATM   41  H   UNL     1       5.780   1.357  -1.920  1.00  0.00           H  
HETATM   42  H   UNL     1       0.762  -2.094   1.039  1.00  0.00           H  
HETATM   43  H   UNL     1       0.889   1.433  -0.324  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.814   2.525  -0.153  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.039   0.959   0.933  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.793   3.039   1.506  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.402   3.775   0.660  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.027   4.098  -0.168  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.633   4.158  -1.290  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.460   1.775  -0.651  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.966   2.398  -2.258  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.707   1.597  -1.996  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.649   0.286  -1.217  1.00  0.00           H  
CONECT    1    3   24    4    4                                       
CONECT    2   23   23    4   20                                       
CONECT    3    5    5    1                                            
CONECT    4    1    1    2                                            
CONECT    5   25    3    3   23                                       
CONECT    6    7   31                                                 
CONECT    7    6    8   10   32                                       
CONECT    8    7    9   19   33                                       
CONECT    9    8   34                                                 
CONECT   10    7   11   18   35                                       
CONECT   11   10   12   36   37                                       
CONECT   12   11   13                                                 
CONECT   13   14   12   38   39                                       
CONECT   14   15   15   17   13                                       
CONECT   14   16                                                      
CONECT   15   14   14                                                 
CONECT   16   14   40                                                 
CONECT   17   14   41                                                 
CONECT   18   19   10                                                 
CONECT   19   20    8   18   42                                       
CONECT   20    2   21   19                                            
CONECT   21   22   22   20   43                                       
CONECT   22   23   21   21                                            
CONECT   23    5   22    2    2                                       
CONECT   24    1                                                      
CONECT   25   26    5   44                                            
CONECT   26   30   27   25   45                                       
CONECT   27   26   28   46   47                                       
CONECT   28   29   27   48   49                                       
CONECT   29   30   28   50   51                                       
CONECT   30   29   26   52   53                                       
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   21                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53   30                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
