COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.689  -0.603  -0.580  1.00  0.00           C  
HETATM    2  O   UNL     1      -8.829   0.247  -0.438  1.00  0.00           O  
HETATM    3  C   UNL     1      -8.762   1.419  -1.259  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.650   2.324  -0.722  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.405   1.511  -0.492  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.426   0.196  -0.424  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.158  -0.522  -0.186  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.972   0.199  -0.032  1.00  0.00           C  
HETATM    9  N   UNL     1      -5.155  -1.848  -0.115  1.00  0.00           N  
HETATM   10  C   UNL     1      -4.048  -2.528   0.097  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.831  -1.876   0.255  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.704  -2.590   0.476  1.00  0.00           O  
HETATM   13  C   UNL     1      -2.794  -0.487   0.190  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.502   0.250   0.356  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.418   1.423  -0.642  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.891   2.518   0.172  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.671   2.196   1.463  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.448   0.930   1.657  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.680   3.120   2.479  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.324  -0.662   0.184  1.00  0.00           C  
HETATM   21  C   UNL     1       0.930  -0.125  -0.044  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.485  -2.040   0.248  1.00  0.00           C  
HETATM   23  C   UNL     1       0.616  -2.874   0.085  1.00  0.00           C  
HETATM   24  C   UNL     1       1.867  -2.338  -0.139  1.00  0.00           C  
HETATM   25  C   UNL     1       2.028  -0.959  -0.206  1.00  0.00           C  
HETATM   26  N   UNL     1       3.296  -0.411  -0.437  1.00  0.00           N  
HETATM   27  C   UNL     1       4.390  -1.008   0.076  1.00  0.00           C  
HETATM   28  O   UNL     1       4.286  -2.065   0.666  1.00  0.00           O  
HETATM   29  C   UNL     1       5.720  -0.375  -0.081  1.00  0.00           C  
HETATM   30  C   UNL     1       6.848  -0.997   0.451  1.00  0.00           C  
HETATM   31  C   UNL     1       8.085  -0.393   0.297  1.00  0.00           C  
HETATM   32  C   UNL     1       8.152   0.814  -0.385  1.00  0.00           C  
HETATM   33 CL   UNL     1       9.677   1.616  -0.600  1.00  0.00          Cl  
HETATM   34  C   UNL     1       6.988   1.375  -0.888  1.00  0.00           C  
HETATM   35  N   UNL     1       5.827   0.777  -0.731  1.00  0.00           N  
HETATM   36  H   UNL     1      -7.721  -1.381   0.183  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.704  -1.065  -1.567  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.537   1.133  -2.287  1.00  0.00           H  
HETATM   39  H   UNL     1      -9.716   1.945  -1.225  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.440   3.111  -1.447  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.970   2.773   0.219  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.462   2.024  -0.378  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.977   1.278  -0.087  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.086  -3.606   0.149  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.391   1.590  -0.965  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.075   1.259  -1.496  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.516   2.838   3.393  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.851   4.054   2.283  1.00  0.00           H  
HETATM   49  H   UNL     1       1.056   0.946  -0.096  1.00  0.00           H  
HETATM   50  H   UNL     1       0.491  -3.945   0.135  1.00  0.00           H  
HETATM   51  H   UNL     1       2.719  -2.988  -0.266  1.00  0.00           H  
HETATM   52  H   UNL     1       3.386   0.397  -0.965  1.00  0.00           H  
HETATM   53  H   UNL     1       6.759  -1.936   0.977  1.00  0.00           H  
HETATM   54  H   UNL     1       8.977  -0.851   0.699  1.00  0.00           H  
HETATM   55  H   UNL     1       7.036   2.315  -1.419  1.00  0.00           H  
CONECT    1    6    2   36   37                                       
CONECT    2    3    1                                                 
CONECT    3    4    2   38   39                                       
CONECT    4    5    3   40   41                                       
CONECT    5    4    6    6   42                                       
CONECT    6    5    5    7    1                                       
CONECT    7    8    6    9    9                                       
CONECT    8   13   13    7   43                                       
CONECT    9    7    7   10                                            
CONECT   10   11   11    9   44                                       
CONECT   11   13   12   10   10                                       
CONECT   12   22   11                                                 
CONECT   13   14    8    8   11                                       
CONECT   14   18   20   15   13                                       
CONECT   15   16   14   45   46                                       
CONECT   16   17   15                                                 
CONECT   17   19   18   18   16                                       
CONECT   18   17   17   14                                            
CONECT   19   17   47   48                                            
CONECT   20   21   14   22   22                                       
CONECT   21   25   25   20   49                                       
CONECT   22   20   20   23   12                                       
CONECT   23   24   24   22   50                                       
CONECT   24   25   23   23   51                                       
CONECT   25   26   21   21   24                                       
CONECT   26   27   25   52                                            
CONECT   27   29   26   28   28                                       
CONECT   28   27   27                                                 
CONECT   29   35   35   30   27                                       
CONECT   30   31   31   29   53                                       
CONECT   31   32   30   30   54                                       
CONECT   32   33   34   34   31                                       
CONECT   33   32                                                      
CONECT   34   32   32   35   55                                       
CONECT   35   34   29   29                                            
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   26                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   34                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
