COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.547  -0.366  -1.398  1.00  0.00           C  
HETATM    2  O   UNL     1       2.039  -0.723  -2.440  1.00  0.00           O  
HETATM    3 CL   UNL     1       2.432  -0.592   3.165  1.00  0.00          Cl  
HETATM    4  C   UNL     1       1.620  -1.565   1.978  1.00  0.00           C  
HETATM    5  C   UNL     1       0.329  -2.004   2.209  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.318  -2.778   1.264  1.00  0.00           C  
HETATM    7  C   UNL     1       0.326  -3.115   0.088  1.00  0.00           C  
HETATM    8  C   UNL     1       1.617  -2.676  -0.144  1.00  0.00           C  
HETATM    9 CL   UNL     1       2.422  -3.093  -1.625  1.00  0.00          Cl  
HETATM   10  C   UNL     1       2.263  -1.897   0.799  1.00  0.00           C  
HETATM   11  C   UNL     1       3.670  -1.419   0.547  1.00  0.00           C  
HETATM   12  C   UNL     1       3.818  -1.022  -0.923  1.00  0.00           C  
HETATM   13  C   UNL     1       4.981  -0.036  -1.072  1.00  0.00           C  
HETATM   14  N   UNL     1       5.000   0.863   0.086  1.00  0.00           N  
HETATM   15  C   UNL     1       3.894   1.659   0.365  1.00  0.00           C  
HETATM   16  N   UNL     1       4.010   2.945   0.411  1.00  0.00           N  
HETATM   17  N   UNL     1       5.227   3.552   0.075  1.00  0.00           N  
HETATM   18  C   UNL     1       5.939   4.364   1.065  1.00  0.00           C  
HETATM   19  C   UNL     1       5.787   3.375  -1.267  1.00  0.00           C  
HETATM   20  C   UNL     1       2.557   1.002   0.613  1.00  0.00           C  
HETATM   21  N   UNL     1       1.973   0.615  -0.678  1.00  0.00           N  
HETATM   22  C   UNL     1       0.775   1.293  -1.179  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.444   0.470  -0.847  1.00  0.00           C  
HETATM   24  O   UNL     1      -0.321  -0.589  -0.268  1.00  0.00           O  
HETATM   25  N   UNL     1      -1.669   0.911  -1.194  1.00  0.00           N  
HETATM   26  C   UNL     1      -2.806   0.191  -0.809  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.017   0.845  -0.640  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.145   0.126  -0.257  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.052  -1.248  -0.045  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.842  -1.893  -0.215  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.723  -1.180  -0.601  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.445   0.820  -0.075  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.685   2.197  -0.253  1.00  0.00           C  
HETATM   34  N   UNL     1      -7.947   2.424   0.000  1.00  0.00           N  
HETATM   35  N   UNL     1      -8.557   1.213   0.347  1.00  0.00           N  
HETATM   36  C   UNL     1      -9.966   1.032   0.704  1.00  0.00           C  
HETATM   37  C   UNL     1      -7.624   0.240   0.290  1.00  0.00           C  
HETATM   38  H   UNL     1      -0.174  -1.742   3.128  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.326  -3.120   1.445  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.180  -3.720  -0.650  1.00  0.00           H  
HETATM   41  H   UNL     1       3.879  -0.557   1.179  1.00  0.00           H  
HETATM   42  H   UNL     1       4.372  -2.220   0.780  1.00  0.00           H  
HETATM   43  H   UNL     1       4.014  -1.911  -1.523  1.00  0.00           H  
HETATM   44  H   UNL     1       5.920  -0.586  -1.123  1.00  0.00           H  
HETATM   45  H   UNL     1       4.849   0.547  -1.984  1.00  0.00           H  
HETATM   46  H   UNL     1       5.784   0.903   0.657  1.00  0.00           H  
HETATM   47  H   UNL     1       6.621   3.730   1.632  1.00  0.00           H  
HETATM   48  H   UNL     1       6.506   5.143   0.557  1.00  0.00           H  
HETATM   49  H   UNL     1       5.220   4.822   1.744  1.00  0.00           H  
HETATM   50  H   UNL     1       5.494   4.215  -1.897  1.00  0.00           H  
HETATM   51  H   UNL     1       6.875   3.331  -1.203  1.00  0.00           H  
HETATM   52  H   UNL     1       5.410   2.448  -1.699  1.00  0.00           H  
HETATM   53  H   UNL     1       2.695   0.116   1.232  1.00  0.00           H  
HETATM   54  H   UNL     1       1.894   1.703   1.120  1.00  0.00           H  
HETATM   55  H   UNL     1       0.689   2.273  -0.711  1.00  0.00           H  
HETATM   56  H   UNL     1       0.849   1.412  -2.260  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.763   1.727  -1.709  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.084   1.911  -0.805  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.926  -1.809   0.252  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.773  -2.959  -0.054  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.780  -1.689  -0.733  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.954   2.935  -0.547  1.00  0.00           H  
HETATM   63  H   UNL     1     -10.544   0.820  -0.196  1.00  0.00           H  
HETATM   64  H   UNL     1     -10.060   0.200   1.401  1.00  0.00           H  
HETATM   65  H   UNL     1     -10.342   1.942   1.171  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.782  -0.808   0.499  1.00  0.00           H  
CONECT    1    2    2   21   12                                       
CONECT    2    1    1                                                 
CONECT    3    4                                                      
CONECT    4   10    5    5    3                                       
CONECT    5    4    4    6   38                                       
CONECT    6    7    7    5   39                                       
CONECT    7    8    6    6   40                                       
CONECT    8    9   10   10    7                                       
CONECT    9    8                                                      
CONECT   10   11    8    8    4                                       
CONECT   11   12   10   41   42                                       
CONECT   12    1   11   13   43                                       
CONECT   13   12   14   44   45                                       
CONECT   14   13   15   46                                            
CONECT   15   20   14   16   16                                       
CONECT   16   15   15   17                                            
CONECT   17   18   16   19                                            
CONECT   18   17   47   48   49                                       
CONECT   19   17   50   51   52                                       
CONECT   20   21   15   53   54                                       
CONECT   21   22    1   20                                            
CONECT   22   23   21   55   56                                       
CONECT   23   25   22   24   24                                       
CONECT   24   23   23                                                 
CONECT   25   26   23   57                                            
CONECT   26   31   25   27   27                                       
CONECT   27   26   26   28   58                                       
CONECT   28   29   29   27   32                                       
CONECT   29   30   28   28   59                                       
CONECT   30   31   31   29   60                                       
CONECT   31   30   30   26   61                                       
CONECT   32   28   37   37   33                                       
CONECT   33   32   34   34   62                                       
CONECT   34   35   33   33                                            
CONECT   35   37   36   34                                            
CONECT   36   35   63   64   65                                       
CONECT   37   32   32   35   66                                       
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   22                                                      
CONECT   56   22                                                      
CONECT   57   25                                                      
CONECT   58   27                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   33                                                      
CONECT   63   36                                                      
CONECT   64   36                                                      
CONECT   65   36                                                      
CONECT   66   37                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
