COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.146  -3.379  -1.639  1.00  0.00           C  
HETATM    2  C   UNL     1       1.370  -2.047  -1.932  1.00  0.00           C  
HETATM    3  C   UNL     1       0.297  -3.726  -0.604  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.790  -1.802   0.047  1.00  0.00           C  
HETATM    5  C   UNL     1       0.751  -1.061  -1.186  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.323  -2.740   0.141  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.549  -1.419  -0.418  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.607   0.439  -0.331  1.00  0.00           C  
HETATM    9  C   UNL     1       4.674  -0.690   1.195  1.00  0.00           C  
HETATM   10  C   UNL     1       3.814   1.011  -0.254  1.00  0.00           C  
HETATM   11  C   UNL     1       5.825  -0.154  -0.837  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.831  -0.872   0.094  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.093  -1.408  -0.148  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.333  -0.117  -0.833  1.00  0.00           C  
HETATM   15  C   UNL     1       3.718   0.265   0.906  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.358   0.811  -0.783  1.00  0.00           C  
HETATM   17  C   UNL     1       5.728  -0.900   0.324  1.00  0.00           C  
HETATM   18  C   UNL     1       4.868   0.802  -1.126  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.163  -1.274   0.590  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.926   2.404   1.597  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.488   1.285   2.545  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.858   1.827   0.530  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.769  -0.333   0.664  1.00  0.00           C  
HETATM   24  C   UNL     1       0.197   0.179   1.735  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.974   0.293  -1.340  1.00  0.00           C  
HETATM   26  C   UNL     1       2.857   1.724   2.717  1.00  0.00           C  
HETATM   27  C   UNL     1       2.570   0.493   1.855  1.00  0.00           C  
HETATM   28  N   UNL     1      -4.119   2.200  -1.234  1.00  0.00           N1+
HETATM   29  N   UNL     1      -1.158   0.775  -0.217  1.00  0.00           N  
HETATM   30  O   UNL     1      -8.066  -0.464   0.630  1.00  0.00           O  
HETATM   31  O   UNL     1      -4.977   3.049  -1.069  1.00  0.00           O1-
HETATM   32  O   UNL     1      -7.375  -2.540   0.999  1.00  0.00           O  
HETATM   33  O   UNL     1      -3.065   2.494  -1.768  1.00  0.00           O  
HETATM   34  O   UNL     1       3.092   2.852   1.872  1.00  0.00           O  
HETATM   35  O   UNL     1       1.369   0.703   1.109  1.00  0.00           O  
HETATM   36 CL   UNL     1       6.930  -2.099   0.687  1.00  0.00          Cl  
HETATM   37 CL   UNL     1       4.988   1.739  -2.582  1.00  0.00          Cl  
HETATM   38  H   UNL     1       1.630  -4.149  -2.221  1.00  0.00           H  
HETATM   39  H   UNL     1       2.030  -1.776  -2.743  1.00  0.00           H  
HETATM   40  H   UNL     1       0.119  -4.767  -0.378  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.957  -2.818   0.370  1.00  0.00           H  
HETATM   42  H   UNL     1       0.927  -0.021  -1.415  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.986  -3.011   0.949  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.744  -2.138  -0.459  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.407   1.164  -0.292  1.00  0.00           H  
HETATM   46  H   UNL     1       4.601  -1.270   2.103  1.00  0.00           H  
HETATM   47  H   UNL     1       3.066   1.757  -0.479  1.00  0.00           H  
HETATM   48  H   UNL     1       6.648  -0.317  -1.518  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.451   3.174   2.161  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.049   2.839   1.117  1.00  0.00           H  
HETATM   51  H   UNL     1       0.211   1.683   3.280  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.360   0.876   3.054  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.742   1.405   1.009  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.161   2.619  -0.156  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.657  -0.745   1.143  1.00  0.00           H  
HETATM   56  H   UNL     1       0.473  -0.640   2.399  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.485  -0.564  -1.803  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.086   1.089  -2.076  1.00  0.00           H  
HETATM   59  H   UNL     1       2.001   1.924   3.361  1.00  0.00           H  
HETATM   60  H   UNL     1       3.739   1.540   3.330  1.00  0.00           H  
HETATM   61  H   UNL     1       2.451  -0.380   2.497  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.263  -2.756   1.315  1.00  0.00           H  
HETATM   63  H   UNL     1       3.281   3.671   2.352  1.00  0.00           H  
CONECT    1    3    3    2   38                                       
CONECT    2    5    5    1   39                                       
CONECT    3    6    1    1   40                                       
CONECT    4   12   12    7   41                                       
CONECT    5   13    2    2   42                                       
CONECT    6   13   13    3   43                                       
CONECT    7   14   14    4   44                                       
CONECT    8   16   16   12   45                                       
CONECT    9   15   15   17   46                                       
CONECT   10   15   18   18   47                                       
CONECT   11   17   17   18   48                                       
CONECT   12    8   19    4    4                                       
CONECT   13   23    6    6    5                                       
CONECT   14   16   25    7    7                                       
CONECT   15   27    9    9   10                                       
CONECT   16   28    8    8   14                                       
CONECT   17    9   36   11   11                                       
CONECT   18   10   10   11   37                                       
CONECT   19   30   30   12   32                                       
CONECT   20   21   22   49   50                                       
CONECT   21   20   24   51   52                                       
CONECT   22   20   29   53   54                                       
CONECT   23   24   29   13   55                                       
CONECT   24   21   35   23   56                                       
CONECT   25   29   14   57   58                                       
CONECT   26   34   27   59   60                                       
CONECT   27   35   26   15   61                                       
CONECT   28   33   33   16   31                                       
CONECT   29   22   23   25                                            
CONECT   30   19   19                                                 
CONECT   31   28                                                      
CONECT   32   19   62                                                 
CONECT   33   28   28                                                 
CONECT   34   26   63                                                 
CONECT   35   24   27                                                 
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   32                                                      
CONECT   63   34                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
