COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.642  -1.949  -2.754  1.00  0.00           C  
HETATM    2  C   UNL     1       4.406  -1.278  -1.570  1.00  0.00           C  
HETATM    3  C   UNL     1       3.240  -1.521  -0.860  1.00  0.00           C  
HETATM    4  C   UNL     1       2.308  -2.450  -1.353  1.00  0.00           C  
HETATM    5  C   UNL     1       2.559  -3.119  -2.549  1.00  0.00           C  
HETATM    6  C   UNL     1       1.076  -2.693  -0.581  1.00  0.00           C  
HETATM    7  C   UNL     1       1.822  -1.110   1.028  1.00  0.00           C  
HETATM    8  C   UNL     1       6.100  -0.154   0.601  1.00  0.00           C  
HETATM    9  C   UNL     1       7.321   0.398   0.276  1.00  0.00           C  
HETATM   10  C   UNL     1       7.439   1.762   0.071  1.00  0.00           C  
HETATM   11  C   UNL     1       6.330   2.585   0.190  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.335  -2.247   1.349  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.437  -1.360   0.831  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.162  -0.419  -0.146  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.167   0.396  -0.625  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.464   0.270  -0.124  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.735  -0.681   0.861  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.722  -1.494   1.329  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.293  -0.551  -0.011  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.624  -0.859  -0.742  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.226   0.562  -0.905  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.980   1.440  -1.148  1.00  0.00           C  
HETATM   23  C   UNL     1       3.724  -2.865  -3.241  1.00  0.00           C  
HETATM   24  N   UNL     1       0.885  -2.016   0.571  1.00  0.00           N  
HETATM   25  N   UNL     1       2.972  -0.865   0.333  1.00  0.00           N  
HETATM   26  C   UNL     1       3.662   0.073   1.061  1.00  0.00           C  
HETATM   27  N   UNL     1       2.934   0.347   2.120  1.00  0.00           N  
HETATM   28  N   UNL     1       1.852  -0.348   2.101  1.00  0.00           N  
HETATM   29  C   UNL     1       4.974   0.663   0.719  1.00  0.00           C  
HETATM   30  O   UNL     1       6.453   3.925  -0.008  1.00  0.00           O  
HETATM   31  C   UNL     1       7.753   4.414  -0.341  1.00  0.00           C  
HETATM   32  C   UNL     1       5.093   2.042   0.517  1.00  0.00           C  
HETATM   33  O   UNL     1       4.004   2.846   0.635  1.00  0.00           O  
HETATM   34 CL   UNL     1      -3.058  -2.683   2.549  1.00  0.00          Cl  
HETATM   35  C   UNL     1      -4.544   1.140  -0.633  1.00  0.00           C  
HETATM   36  O   UNL     1      -4.280   2.239  -1.081  1.00  0.00           O  
HETATM   37  N   UNL     1      -5.823   0.716  -0.601  1.00  0.00           N  
HETATM   38  C   UNL     1      -7.140   2.763  -0.444  1.00  0.00           C  
HETATM   39  O   UNL     1      -8.148   3.583  -0.779  1.00  0.00           O  
HETATM   40  O   UNL     1      -6.362   3.084   0.422  1.00  0.00           O  
HETATM   41  O   UNL     1       0.245  -3.489  -0.976  1.00  0.00           O  
HETATM   42  H   UNL     1       5.549  -1.754  -3.307  1.00  0.00           H  
HETATM   43  H   UNL     1       5.127  -0.566  -1.198  1.00  0.00           H  
HETATM   44  H   UNL     1       1.845  -3.834  -2.931  1.00  0.00           H  
HETATM   45  H   UNL     1       6.014  -1.219   0.760  1.00  0.00           H  
HETATM   46  H   UNL     1       8.190  -0.236   0.182  1.00  0.00           H  
HETATM   47  H   UNL     1       8.399   2.186  -0.183  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.146  -2.016   2.398  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.634  -3.291   1.255  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.159  -0.322  -0.533  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.951   1.130  -1.387  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.736  -0.784   1.253  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.467  -0.430   1.058  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.570  -1.346  -0.190  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.439  -1.318  -1.713  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.269  -1.490  -0.131  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.898   0.600  -1.763  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.745   0.867   0.004  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.844   1.603  -2.217  1.00  0.00           H  
HETATM   60  H   UNL     1       3.920  -3.379  -4.170  1.00  0.00           H  
HETATM   61  H   UNL     1       8.450   4.172   0.462  1.00  0.00           H  
HETATM   62  H   UNL     1       8.090   3.949  -1.268  1.00  0.00           H  
HETATM   63  H   UNL     1       7.712   5.496  -0.472  1.00  0.00           H  
HETATM   64  H   UNL     1       3.512   2.965  -0.189  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.210   4.421  -0.300  1.00  0.00           H  
CONECT    1    2    2   23   42                                       
CONECT    2    1    1    3   43                                       
CONECT    3   25    2    4    4                                       
CONECT    4    3    3    5    6                                       
CONECT    5   23   23    4   44                                       
CONECT    6    4   24   41   41                                       
CONECT    7   25   28   28   24                                       
CONECT    8   29   29    9   45                                       
CONECT    9   10   10    8   46                                       
CONECT   10   11    9    9   47                                       
CONECT   11   30   32   32   10                                       
CONECT   12   24   13   48   49                                       
CONECT   13   12   18   18   14                                       
CONECT   14   13   15   15   50                                       
CONECT   15   14   14   16   51                                       
CONECT   16   17   17   15   35                                       
CONECT   17   18   16   16   52                                       
CONECT   18   34   13   13   17                                       
CONECT   19   37   20   53   54                                       
CONECT   20   19   21   55   56                                       
CONECT   21   22   20   57   58                                       
CONECT   22   37   38   21   59                                       
CONECT   23    1    5    5   60                                       
CONECT   24    7   12    6                                            
CONECT   25   26    3    7                                            
CONECT   26   29   27   27   25                                       
CONECT   27   26   26   28                                            
CONECT   28   27    7    7                                            
CONECT   29   32   26    8    8                                       
CONECT   30   31   11                                                 
CONECT   31   30   61   62   63                                       
CONECT   32   33   11   11   29                                       
CONECT   33   32   64                                                 
CONECT   34   18                                                      
CONECT   35   16   36   36   37                                       
CONECT   36   35   35                                                 
CONECT   37   35   22   19                                            
CONECT   38   40   40   22   39                                       
CONECT   39   38   65                                                 
CONECT   40   38   38                                                 
CONECT   41    6    6                                                 
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    5                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   17                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   33                                                      
CONECT   65   39                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
