COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.592   5.401   2.836  1.00  0.00           C  
HETATM    2  C   UNL     1       0.972   4.892   1.534  1.00  0.00           C  
HETATM    3  N   UNL     1       1.613   3.632   1.148  1.00  0.00           N  
HETATM    4  C   UNL     1       1.226   2.995   0.025  1.00  0.00           C  
HETATM    5  O   UNL     1       0.347   3.465  -0.666  1.00  0.00           O  
HETATM    6  C   UNL     1       1.886   1.700  -0.372  1.00  0.00           C  
HETATM    7  C   UNL     1       3.384   1.933  -0.577  1.00  0.00           C  
HETATM    8  C   UNL     1       1.266   1.190  -1.675  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.163   0.926  -1.475  1.00  0.00           N  
HETATM   10  C   UNL     1       1.921  -0.106  -2.079  1.00  0.00           C  
HETATM   11  N   UNL     1       2.582  -0.352  -3.174  1.00  0.00           N  
HETATM   12  N   UNL     1       2.957  -1.585  -3.185  1.00  0.00           N  
HETATM   13  C   UNL     1       2.562  -2.180  -2.090  1.00  0.00           C  
HETATM   14  C   UNL     1       2.783  -3.626  -1.725  1.00  0.00           C  
HETATM   15  N   UNL     1       1.914  -1.247  -1.344  1.00  0.00           N  
HETATM   16  C   UNL     1       1.378  -1.395  -0.064  1.00  0.00           C  
HETATM   17  C   UNL     1       2.036  -2.227   0.832  1.00  0.00           C  
HETATM   18  C   UNL     1       1.561  -2.380   2.125  1.00  0.00           C  
HETATM   19  O   UNL     1       2.209  -3.197   2.995  1.00  0.00           O  
HETATM   20  C   UNL     1       1.663  -3.307   4.311  1.00  0.00           C  
HETATM   21  C   UNL     1       0.421  -1.696   2.530  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.246  -0.881   1.647  1.00  0.00           C  
HETATM   23  C   UNL     1       0.213  -0.729   0.329  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.584   0.093  -0.587  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.054  -0.053  -0.478  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.892   0.991  -0.870  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.260   0.850  -0.766  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.802  -0.326  -0.275  1.00  0.00           C  
HETATM   29 CL   UNL     1      -6.525  -0.494  -0.142  1.00  0.00          Cl  
HETATM   30  C   UNL     1      -3.975  -1.365   0.115  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.606  -1.237   0.011  1.00  0.00           C  
HETATM   32  H   UNL     1       1.443   4.662   3.623  1.00  0.00           H  
HETATM   33  H   UNL     1       2.659   5.567   2.690  1.00  0.00           H  
HETATM   34  H   UNL     1       1.114   6.338   3.124  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.095   4.726   1.680  1.00  0.00           H  
HETATM   36  H   UNL     1       1.120   5.631   0.747  1.00  0.00           H  
HETATM   37  H   UNL     1       2.317   3.257   1.700  1.00  0.00           H  
HETATM   38  H   UNL     1       1.738   0.961   0.414  1.00  0.00           H  
HETATM   39  H   UNL     1       3.533   2.672  -1.364  1.00  0.00           H  
HETATM   40  H   UNL     1       3.826   2.296   0.351  1.00  0.00           H  
HETATM   41  H   UNL     1       3.862   0.996  -0.865  1.00  0.00           H  
HETATM   42  H   UNL     1       1.399   1.932  -2.462  1.00  0.00           H  
HETATM   43  H   UNL     1       3.722  -3.724  -1.181  1.00  0.00           H  
HETATM   44  H   UNL     1       1.961  -3.971  -1.096  1.00  0.00           H  
HETATM   45  H   UNL     1       2.824  -4.228  -2.632  1.00  0.00           H  
HETATM   46  H   UNL     1       2.923  -2.758   0.520  1.00  0.00           H  
HETATM   47  H   UNL     1       1.653  -2.324   4.784  1.00  0.00           H  
HETATM   48  H   UNL     1       0.645  -3.691   4.251  1.00  0.00           H  
HETATM   49  H   UNL     1       2.274  -3.988   4.903  1.00  0.00           H  
HETATM   50  H   UNL     1       0.057  -1.805   3.541  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.130  -0.353   1.969  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.470   1.909  -1.253  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.910   1.658  -1.069  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.403  -2.280   0.498  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.961  -2.049   0.316  1.00  0.00           H  
CONECT    1    2   32   33   34                                       
CONECT    2    1    3   35   36                                       
CONECT    3    2    4   37                                            
CONECT    4    3    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4    8    7   38                                       
CONECT    7    6   39   40   41                                       
CONECT    8    9    6   10   42                                       
CONECT    9   24   24    8                                            
CONECT   10    8   15   11   11                                       
CONECT   11   10   10   12                                            
CONECT   12   11   13   13                                            
CONECT   13   15   12   12   14                                       
CONECT   14   13   43   44   45                                       
CONECT   15   16   10   13                                            
CONECT   16   23   15   17   17                                       
CONECT   17   16   16   18   46                                       
CONECT   18   21   21   17   19                                       
CONECT   19   18   20                                                 
CONECT   20   19   47   48   49                                       
CONECT   21   22   18   18   50                                       
CONECT   22   23   23   21   51                                       
CONECT   23   24   22   22   16                                       
CONECT   24   25    9    9   23                                       
CONECT   25   31   31   26   24                                       
CONECT   26   27   27   25   52                                       
CONECT   27   28   26   26   53                                       
CONECT   28   29   30   30   27                                       
CONECT   29   28                                                      
CONECT   30   28   28   31   54                                       
CONECT   31   30   25   25   55                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   17                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
