COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.704   0.643  -0.360  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.361  -0.674  -0.712  1.00  0.00           C  
HETATM    3  C   UNL     1       0.933  -1.130  -0.526  1.00  0.00           C  
HETATM    4  C   UNL     1       3.285  -0.779   0.208  1.00  0.00           C  
HETATM    5  C   UNL     1       4.367  -0.037  -0.264  1.00  0.00           C  
HETATM    6  C   UNL     1       5.655  -0.500  -0.072  1.00  0.00           C  
HETATM    7  C   UNL     1       5.871  -1.697   0.585  1.00  0.00           C  
HETATM    8  C   UNL     1       7.277  -2.198   0.791  1.00  0.00           C  
HETATM    9  C   UNL     1       4.800  -2.438   1.055  1.00  0.00           C  
HETATM   10  C   UNL     1       3.510  -1.985   0.870  1.00  0.00           C  
HETATM   11  C   UNL     1       1.576   1.024   0.365  1.00  0.00           C  
HETATM   12  C   UNL     1       0.280   1.497   0.184  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.063   2.880   0.558  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.919  -0.503  -1.583  1.00  0.00           C  
HETATM   15  C   UNL     1       1.901  -0.284   0.011  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.077  -1.323  -0.848  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.873  -1.772   0.380  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.636  -0.254   1.760  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.827   0.210   0.546  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.491  -0.303  -1.145  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.517  -1.248  -1.207  1.00  0.00           N  
HETATM   22  N   UNL     1      -4.737  -0.890  -0.426  1.00  0.00           N  
HETATM   23  N   UNL     1      -2.012   0.800  -0.644  1.00  0.00           N  
HETATM   24  O   UNL     1       0.880   3.691   1.077  1.00  0.00           O  
HETATM   25  O   UNL     1      -1.196   3.289   0.398  1.00  0.00           O  
HETATM   26  O   UNL     1      -6.924  -0.701   1.327  1.00  0.00           O  
HETATM   27 CL   UNL     1       4.097   1.466  -1.090  1.00  0.00          Cl  
HETATM   28  H   UNL     1       1.193  -2.142  -0.797  1.00  0.00           H  
HETATM   29  H   UNL     1       6.494   0.073  -0.437  1.00  0.00           H  
HETATM   30  H   UNL     1       7.663  -1.818   1.737  1.00  0.00           H  
HETATM   31  H   UNL     1       7.276  -3.288   0.811  1.00  0.00           H  
HETATM   32  H   UNL     1       7.910  -1.850  -0.025  1.00  0.00           H  
HETATM   33  H   UNL     1       4.975  -3.372   1.568  1.00  0.00           H  
HETATM   34  H   UNL     1       2.675  -2.564   1.237  1.00  0.00           H  
HETATM   35  H   UNL     1       2.332   1.673   0.781  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.304   0.425  -2.006  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.961  -1.291  -2.336  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.986  -2.155  -1.547  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.592  -0.494  -1.333  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.885  -2.040   0.080  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.386  -2.636   0.834  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.113  -1.074   2.254  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.754   0.575   2.458  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.323   1.064   0.084  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.826   0.499   0.864  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.615  -2.155  -1.537  1.00  0.00           H  
HETATM   47  H   UNL     1       0.608   4.590   1.306  1.00  0.00           H  
CONECT    1   23    2    2   12                                       
CONECT    2    1    1   21    3                                       
CONECT    3    2   15   15   28                                       
CONECT    4   15    5    5   10                                       
CONECT    5    4    4   27    6                                       
CONECT    6    5    7    7   29                                       
CONECT    7    6    6    8    9                                       
CONECT    8    7   30   31   32                                       
CONECT    9    7   10   10   33                                       
CONECT   10    4    9    9   34                                       
CONECT   11   15   12   12   35                                       
CONECT   12    1   11   11   13                                       
CONECT   13   12   24   25   25                                       
CONECT   14   22   20   36   37                                       
CONECT   15    3    3    4   11                                       
CONECT   16   22   17   38   39                                       
CONECT   17   16   26   40   41                                       
CONECT   18   26   19   42   43                                       
CONECT   19   22   18   44   45                                       
CONECT   20   14   23   23   21                                       
CONECT   21   20    2   46                                            
CONECT   22   14   16   19                                            
CONECT   23   20   20    1                                            
CONECT   24   13   47                                                 
CONECT   25   13   13                                                 
CONECT   26   17   18                                                 
CONECT   27    5                                                      
CONECT   28    3                                                      
CONECT   29    6                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   24                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
