COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.473   4.017   1.587  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.561   3.363   0.697  1.00  0.00           C  
HETATM    3  C   UNL     1       1.712  -0.130   1.288  1.00  0.00           C  
HETATM    4  C   UNL     1       1.959   1.193   0.954  1.00  0.00           C  
HETATM    5  C   UNL     1       0.939   1.981   0.439  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.323   1.449   0.257  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.573   0.127   0.589  1.00  0.00           C  
HETATM    8  C   UNL     1       0.447  -0.665   1.106  1.00  0.00           C  
HETATM    9  O   UNL     1      -1.816  -0.396   0.409  1.00  0.00           O  
HETATM   10  O   UNL     1       0.205  -1.964   1.428  1.00  0.00           O  
HETATM   11  C   UNL     1      -2.787   0.419  -0.081  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.897   0.620  -1.451  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.883   1.449  -1.958  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.765   2.081  -1.104  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.662   1.884   0.276  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.669   1.043   0.785  1.00  0.00           C  
HETATM   17 CL   UNL     1      -4.011   1.694  -3.671  1.00  0.00          Cl  
HETATM   18  C   UNL     1      -5.600   2.556   1.191  1.00  0.00           C  
HETATM   19  C   UNL     1       1.300  -2.719   1.949  1.00  0.00           C  
HETATM   20  C   UNL     1       0.839  -4.146   2.250  1.00  0.00           C  
HETATM   21  N   UNL     1       0.468  -4.814   0.999  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.798  -4.732   0.550  1.00  0.00           C  
HETATM   23  N   UNL     1      -1.166  -5.335  -0.595  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.265  -6.035  -1.314  1.00  0.00           C  
HETATM   25  C   UNL     1       1.070  -6.130  -0.853  1.00  0.00           C  
HETATM   26  C   UNL     1       1.413  -5.510   0.296  1.00  0.00           C  
HETATM   27  O   UNL     1      -1.620  -4.104   1.188  1.00  0.00           O  
HETATM   28  O   UNL     1      -0.598  -6.582  -2.351  1.00  0.00           O  
HETATM   29  N   UNL     1      -8.197   4.535   2.292  1.00  0.00           N  
HETATM   30  O   UNL     1       3.200   1.719   1.132  1.00  0.00           O  
HETATM   31  C   UNL     1       3.383   3.088   0.767  1.00  0.00           C  
HETATM   32  C   UNL     1       4.832   3.498   1.037  1.00  0.00           C  
HETATM   33  N   UNL     1       5.730   2.720   0.174  1.00  0.00           N  
HETATM   34  C   UNL     1       5.689   3.214  -1.210  1.00  0.00           C  
HETATM   35  C   UNL     1       7.105   2.737   0.693  1.00  0.00           C  
HETATM   36  C   UNL     1       6.591   2.339  -2.085  1.00  0.00           C  
HETATM   37  C   UNL     1       7.993   1.867  -0.201  1.00  0.00           C  
HETATM   38  O   UNL     1       7.917   2.343  -1.548  1.00  0.00           O  
HETATM   39  H   UNL     1      -6.645   3.513  -0.369  1.00  0.00           H  
HETATM   40  H   UNL     1       2.507  -0.745   1.685  1.00  0.00           H  
HETATM   41  H   UNL     1       1.133   3.011   0.180  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.115   2.064  -0.144  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.209   0.128  -2.124  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.533   2.727  -1.503  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.586   0.883   1.849  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.519   2.403   2.257  1.00  0.00           H  
HETATM   47  H   UNL     1       2.105  -2.745   1.214  1.00  0.00           H  
HETATM   48  H   UNL     1       1.660  -2.252   2.866  1.00  0.00           H  
HETATM   49  H   UNL     1       1.649  -4.697   2.729  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.023  -4.117   2.915  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.082  -5.266  -0.905  1.00  0.00           H  
HETATM   52  H   UNL     1       1.805  -6.686  -1.416  1.00  0.00           H  
HETATM   53  H   UNL     1       2.428  -5.567   0.661  1.00  0.00           H  
HETATM   54  H   UNL     1       3.160   3.215  -0.292  1.00  0.00           H  
HETATM   55  H   UNL     1       2.712   3.714   1.357  1.00  0.00           H  
HETATM   56  H   UNL     1       4.954   4.561   0.825  1.00  0.00           H  
HETATM   57  H   UNL     1       5.076   3.306   2.082  1.00  0.00           H  
HETATM   58  H   UNL     1       4.666   3.168  -1.583  1.00  0.00           H  
HETATM   59  H   UNL     1       6.042   4.245  -1.240  1.00  0.00           H  
HETATM   60  H   UNL     1       7.481   3.760   0.694  1.00  0.00           H  
HETATM   61  H   UNL     1       7.116   2.344   1.709  1.00  0.00           H  
HETATM   62  H   UNL     1       6.207   1.319  -2.099  1.00  0.00           H  
HETATM   63  H   UNL     1       6.608   2.735  -3.101  1.00  0.00           H  
HETATM   64  H   UNL     1       9.025   1.922   0.146  1.00  0.00           H  
HETATM   65  H   UNL     1       7.650   0.833  -0.160  1.00  0.00           H  
CONECT    1    2   29   29   29                                       
CONECT    2   18   18    1   39                                       
CONECT    3    4    4    8   40                                       
CONECT    4   30    3    3    5                                       
CONECT    5    4    6    6   41                                       
CONECT    6    5    5    7   42                                       
CONECT    7    6    8    8    9                                       
CONECT    8    3   10    7    7                                       
CONECT    9    7   11                                                 
CONECT   10   19    8                                                 
CONECT   11    9   12   12   16                                       
CONECT   12   11   11   13   43                                       
CONECT   13   12   17   14   14                                       
CONECT   14   13   13   15   44                                       
CONECT   15   16   16   14   18                                       
CONECT   16   11   15   15   45                                       
CONECT   17   13                                                      
CONECT   18   15    2    2   46                                       
CONECT   19   10   20   47   48                                       
CONECT   20   19   21   49   50                                       
CONECT   21   20   22   26                                            
CONECT   22   27   27   21   23                                       
CONECT   23   22   24   51                                            
CONECT   24   23   25   28   28                                       
CONECT   25   26   26   24   52                                       
CONECT   26   21   25   25   53                                       
CONECT   27   22   22                                                 
CONECT   28   24   24                                                 
CONECT   29    1    1    1                                            
CONECT   30   31    4                                                 
CONECT   31   32   30   54   55                                       
CONECT   32   33   31   56   57                                       
CONECT   33   34   35   32                                            
CONECT   34   36   33   58   59                                       
CONECT   35   37   33   60   61                                       
CONECT   36   38   34   62   63                                       
CONECT   37   38   35   64   65                                       
CONECT   38   36   37                                                 
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43   12                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   23                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   32                                                      
CONECT   58   34                                                      
CONECT   59   34                                                      
CONECT   60   35                                                      
CONECT   61   35                                                      
CONECT   62   36                                                      
CONECT   63   36                                                      
CONECT   64   37                                                      
CONECT   65   37                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
