COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.097  -0.880  -2.120  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.608   0.025  -0.678  1.00  0.00           C  
HETATM    3  C   UNL     1       1.221  -0.721  -1.094  1.00  0.00           C  
HETATM    4  C   UNL     1       1.853   0.639  -1.249  1.00  0.00           C  
HETATM    5  C   UNL     1       7.562   0.360   1.368  1.00  0.00           C  
HETATM    6  C   UNL     1       3.498   2.326  -0.585  1.00  0.00           C  
HETATM    7  C   UNL     1       5.009   2.141  -0.755  1.00  0.00           C  
HETATM    8  C   UNL     1       5.551   1.308   0.409  1.00  0.00           C  
HETATM    9  C   UNL     1       7.665   2.466   0.177  1.00  0.00           C  
HETATM   10  C   UNL     1       4.891  -0.073   0.400  1.00  0.00           C  
HETATM   11  C   UNL     1       3.379   0.087   0.584  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.077  -4.232  -2.593  1.00  0.00           N  
HETATM   13  N   UNL     1      -0.481  -3.168  -3.007  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.459  -2.280  -2.055  1.00  0.00           C  
HETATM   15  N   UNL     1       2.872   1.004  -0.446  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.194  -5.080  -0.504  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.451  -4.077  -1.349  1.00  0.00           C  
HETATM   18  N   UNL     1       7.005   1.156   0.266  1.00  0.00           N  
HETATM   19  O   UNL     1       1.444   1.405  -2.096  1.00  0.00           O  
HETATM   20  N   UNL     1      -0.996   0.049  -1.810  1.00  0.00           N  
HETATM   21  C   UNL     1      -2.673   1.038  -0.494  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.645   2.224  -1.227  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.639   3.164  -1.052  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.664   2.931  -0.151  1.00  0.00           C  
HETATM   25 CL   UNL     1      -5.913   4.118   0.064  1.00  0.00          Cl  
HETATM   26  C   UNL     1      -4.698   1.755   0.580  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.711   0.806   0.408  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.381  -0.883   0.452  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.157  -2.253   0.297  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.996  -3.062   1.416  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.026  -2.519   2.684  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.220  -1.153   2.848  1.00  0.00           C  
HETATM   33  O   UNL     1      -1.235  -0.616   4.097  1.00  0.00           O  
HETATM   34  C   UNL     1      -1.045  -1.514   5.192  1.00  0.00           C  
HETATM   35  C   UNL     1      -1.398  -0.341   1.746  1.00  0.00           C  
HETATM   36  N   UNL     1      -1.042  -2.839  -0.965  1.00  0.00           N  
HETATM   37  H   UNL     1       0.479  -0.680  -3.121  1.00  0.00           H  
HETATM   38  H   UNL     1       0.813  -0.819  -0.089  1.00  0.00           H  
HETATM   39  H   UNL     1       1.974  -1.492  -1.258  1.00  0.00           H  
HETATM   40  H   UNL     1       7.106  -0.630   1.368  1.00  0.00           H  
HETATM   41  H   UNL     1       8.640   0.263   1.238  1.00  0.00           H  
HETATM   42  H   UNL     1       7.353   0.856   2.316  1.00  0.00           H  
HETATM   43  H   UNL     1       3.301   2.919   0.308  1.00  0.00           H  
HETATM   44  H   UNL     1       3.089   2.834  -1.458  1.00  0.00           H  
HETATM   45  H   UNL     1       5.209   1.626  -1.695  1.00  0.00           H  
HETATM   46  H   UNL     1       5.496   3.116  -0.763  1.00  0.00           H  
HETATM   47  H   UNL     1       5.329   1.811   1.350  1.00  0.00           H  
HETATM   48  H   UNL     1       8.741   2.324   0.073  1.00  0.00           H  
HETATM   49  H   UNL     1       7.283   3.007  -0.688  1.00  0.00           H  
HETATM   50  H   UNL     1       7.460   3.038   1.082  1.00  0.00           H  
HETATM   51  H   UNL     1       5.092  -0.567  -0.550  1.00  0.00           H  
HETATM   52  H   UNL     1       5.295  -0.674   1.215  1.00  0.00           H  
HETATM   53  H   UNL     1       2.893  -0.884   0.480  1.00  0.00           H  
HETATM   54  H   UNL     1       3.172   0.497   1.572  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.479  -5.716   0.018  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.812  -4.554   0.224  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.828  -5.694  -1.143  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.845   2.407  -1.929  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.618   4.083  -1.619  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.500   1.578   1.281  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.738  -0.111   0.978  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.847  -4.124   1.292  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.900  -3.155   3.547  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.079  -0.957   6.129  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.835  -2.265   5.187  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.076  -2.004   5.096  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.550   0.720   1.881  1.00  0.00           H  
CONECT    1   20    3   14   37                                       
CONECT    2   21   20   20   28                                       
CONECT    3    4    1   38   39                                       
CONECT    4   15   19   19    3                                       
CONECT    5   18   40   41   42                                       
CONECT    6    7   15   43   44                                       
CONECT    7    8    6   45   46                                       
CONECT    8   18    7   10   47                                       
CONECT    9   18   48   49   50                                       
CONECT   10    8   11   51   52                                       
CONECT   11   10   15   53   54                                       
CONECT   12   13   17   17                                            
CONECT   13   14   14   12                                            
CONECT   14    1   13   13   36                                       
CONECT   15    6   11    4                                            
CONECT   16   17   55   56   57                                       
CONECT   17   36   12   12   16                                       
CONECT   18    5    8    9                                            
CONECT   19    4    4                                                 
CONECT   20    2    2    1                                            
CONECT   21   27   27   22    2                                       
CONECT   22   23   23   21   58                                       
CONECT   23   24   22   22   59                                       
CONECT   24   25   26   26   23                                       
CONECT   25   24                                                      
CONECT   26   24   24   27   60                                       
CONECT   27   26   21   21   61                                       
CONECT   28    2   35   35   29                                       
CONECT   29   28   36   30   30                                       
CONECT   30   29   29   31   62                                       
CONECT   31   32   32   30   63                                       
CONECT   32   35   33   31   31                                       
CONECT   33   32   34                                                 
CONECT   34   33   64   65   66                                       
CONECT   35   28   28   32   67                                       
CONECT   36   14   29   17                                            
CONECT   37    1                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48    9                                                      
CONECT   49    9                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   11                                                      
CONECT   55   16                                                      
CONECT   56   16                                                      
CONECT   57   16                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   30                                                      
CONECT   63   31                                                      
CONECT   64   34                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
