COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.630  -1.370   0.348  1.00  0.00           C  
HETATM    2  N   UNL     1       1.264  -1.714  -0.055  1.00  0.00           N  
HETATM    3  O   UNL     1       2.830   0.058   0.280  1.00  0.00           O  
HETATM    4  P   UNL     1       4.365   4.204   0.248  1.00  0.00           P  
HETATM    5 CL   UNL     1      -8.054   3.119   1.268  1.00  0.00          Cl  
HETATM    6  C   UNL     1       4.260   0.239   0.201  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.698  -1.570  -0.996  1.00  0.00           N1+
HETATM    8  O   UNL     1       4.196  -3.181  -0.149  1.00  0.00           O  
HETATM    9  C   UNL     1       4.747  -0.876  -0.751  1.00  0.00           C  
HETATM   10  N   UNL     1      -1.249  -4.840   0.642  1.00  0.00           N  
HETATM   11  O   UNL     1       6.004  -1.395  -0.312  1.00  0.00           O  
HETATM   12  C   UNL     1       3.650  -1.959  -0.651  1.00  0.00           C  
HETATM   13  N   UNL     1       0.866  -3.918   1.041  1.00  0.00           N  
HETATM   14  O   UNL     1       4.172   2.631   0.535  1.00  0.00           O  
HETATM   15  C   UNL     1       4.592   1.616  -0.379  1.00  0.00           C  
HETATM   16  N   UNL     1       0.329  -5.963   1.987  1.00  0.00           N  
HETATM   17  O   UNL     1      -2.715  -3.741  -0.640  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.677  -2.742  -0.316  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.902   0.163  -1.628  1.00  0.00           O  
HETATM   20  C   UNL     1       0.577  -2.845   0.296  1.00  0.00           C  
HETATM   21  O   UNL     1       3.743   4.548  -1.050  1.00  0.00           O  
HETATM   22  C   UNL     1       0.442  -0.963  -0.843  1.00  0.00           C  
HETATM   23  O   UNL     1       3.663   5.053   1.422  1.00  0.00           O  
HETATM   24  C   UNL     1      -0.011  -4.883   1.211  1.00  0.00           C  
HETATM   25  O   UNL     1       5.936   4.551   0.199  1.00  0.00           O  
HETATM   26  C   UNL     1      -1.610  -3.789  -0.126  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.828  -1.067  -1.782  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.801  -0.328  -0.862  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.865   0.848  -0.957  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.962   1.353  -1.639  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.940   2.049  -0.955  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.825   2.243   0.410  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.731   1.741   1.093  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.754   1.040   0.413  1.00  0.00           C  
HETATM   35  H   UNL     1       2.831  -1.734   1.356  1.00  0.00           H  
HETATM   36  H   UNL     1       4.713   0.122   1.186  1.00  0.00           H  
HETATM   37  H   UNL     1       4.843  -3.594  -0.737  1.00  0.00           H  
HETATM   38  H   UNL     1       4.825  -0.501  -1.771  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.872  -5.568   0.788  1.00  0.00           H  
HETATM   40  H   UNL     1       6.357  -2.099  -0.874  1.00  0.00           H  
HETATM   41  H   UNL     1       3.182  -2.123  -1.622  1.00  0.00           H  
HETATM   42  H   UNL     1       5.667   1.693  -0.539  1.00  0.00           H  
HETATM   43  H   UNL     1       4.073   1.745  -1.328  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.308  -6.681   2.124  1.00  0.00           H  
HETATM   45  H   UNL     1       1.206  -6.007   2.399  1.00  0.00           H  
HETATM   46  H   UNL     1       0.699  -0.007  -1.275  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.462  -0.384  -2.548  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.341  -1.903  -2.257  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.287   0.508  -0.387  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.167  -1.012  -0.096  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.052   1.202  -2.705  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.794   2.442  -1.486  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.643   1.893   2.158  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.902   0.644   0.946  1.00  0.00           H  
HETATM   55  H   UNL     1       3.740   6.011   1.314  1.00  0.00           H  
HETATM   56  H   UNL     1       6.409   4.351   1.018  1.00  0.00           H  
CONECT    1    2    3   12   35                                       
CONECT    2    1   20   22                                            
CONECT    3    1    6                                                 
CONECT    4   14   21   21   23                                       
CONECT    4   25                                                      
CONECT    5   32                                                      
CONECT    6    3    9   15   36                                       
CONECT    7   18   22   22   27                                       
CONECT    8   12   37                                                 
CONECT    9    6   11   12   38                                       
CONECT   10   24   26   39                                            
CONECT   11    9   40                                                 
CONECT   12    1    8    9   41                                       
CONECT   13   20   24   24                                            
CONECT   14    4   15                                                 
CONECT   15    6   14   42   43                                       
CONECT   16   24   44   45                                            
CONECT   17   26   26                                                 
CONECT   18    7   20   20   26                                       
CONECT   19   28   29                                                 
CONECT   20    2   13   18   18                                       
CONECT   21    4    4                                                 
CONECT   22    2    7    7   46                                       
CONECT   23    4   55                                                 
CONECT   24   10   13   13   16                                       
CONECT   25    4   56                                                 
CONECT   26   10   17   17   18                                       
CONECT   27    7   28   47   48                                       
CONECT   28   19   27   49   50                                       
CONECT   29   19   30   30   34                                       
CONECT   30   29   29   31   51                                       
CONECT   31   30   32   32   52                                       
CONECT   32    5   31   31   33                                       
CONECT   33   32   34   34   53                                       
CONECT   34   29   33   33   54                                       
CONECT   35    1                                                      
CONECT   36    6                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   22                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   33                                                      
CONECT   54   34                                                      
CONECT   55   23                                                      
CONECT   56   25                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
