COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.829  -0.572   0.689  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.714  -0.167   1.392  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.628  -0.402  -1.384  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.491   0.015  -0.687  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.540   0.129   0.713  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.530   0.674  -0.021  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.087   1.110  -0.050  1.00  0.00           C  
HETATM    8  C   UNL     1       3.022   1.447  -0.115  1.00  0.00           C  
HETATM    9  C   UNL     1       2.953  -2.990  -0.095  1.00  0.00           C  
HETATM   10  C   UNL     1       2.002  -1.041  -0.091  1.00  0.00           C  
HETATM   11  C   UNL     1       3.390  -0.827  -0.117  1.00  0.00           C  
HETATM   12  C   UNL     1       2.260   4.208   1.343  1.00  0.00           C  
HETATM   13  C   UNL     1       3.626   4.819  -2.202  1.00  0.00           C  
HETATM   14  C   UNL     1       3.352   5.093  -0.722  1.00  0.00           C  
HETATM   15  CA  UNL     1       2.645   3.887  -0.102  1.00  0.00           C  
HETATM   16  N   UNL     1       7.459  -2.314  -0.738  1.00  0.00           N  
HETATM   17  C   UNL     1      -6.785  -0.692  -0.695  1.00  0.00           C  
HETATM   18  C   UNL     1       5.345  -2.356  -0.141  1.00  0.00           C  
HETATM   19  C   UNL     1       6.002  -3.201   0.694  1.00  0.00           C  
HETATM   20  C   UNL     1       8.377  -3.962   0.982  1.00  0.00           C  
HETATM   21  C   UNL     1       6.286  -1.813  -1.029  1.00  0.00           C  
HETATM   22  C   UNL     1       1.155   0.082  -0.083  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.283   0.548   1.105  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.235   0.362  -1.069  1.00  0.00           N  
HETATM   25  N   UNL     1      -0.220  -0.070  -0.058  1.00  0.00           N  
HETATM   26  N   UNL     1       1.704   1.291  -0.091  1.00  0.00           N  
HETATM   27  N   UNL     1       3.544   2.730  -0.122  1.00  0.00           N  
HETATM   28  N   UNL     1       3.854   0.419  -0.128  1.00  0.00           N  
HETATM   29  N   UNL     1       1.803  -2.382  -0.079  1.00  0.00           N  
HETATM   30  N   UNL     1       3.965  -2.074  -0.119  1.00  0.00           N  
HETATM   31  N   UNL     1       7.308  -3.191   0.343  1.00  0.00           N  
HETATM   32  O   UNL     1       3.422   4.621   2.065  1.00  0.00           O  
HETATM   33 CL   UNL     1      -8.197  -1.210  -1.561  1.00  0.00          Cl  
HETATM   34 CL   UNL     1      -8.297  -0.942   1.540  1.00  0.00          Cl  
HETATM   35  H   UNL     1      -5.754  -0.079   2.467  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.601  -0.497  -2.459  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.905   1.701  -0.947  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.873   1.713   0.833  1.00  0.00           H  
HETATM   39  H   UNL     1       3.088  -4.062  -0.090  1.00  0.00           H  
HETATM   40  H1  UNL     1       1.522   5.011   1.353  1.00  0.00           H  
HETATM   41  H2  UNL     1       1.836   3.321   1.813  1.00  0.00           H  
HETATM   42  H   UNL     1       4.130   5.678  -2.644  1.00  0.00           H  
HETATM   43  H   UNL     1       4.260   3.937  -2.297  1.00  0.00           H  
HETATM   44  H   UNL     1       2.683   4.645  -2.720  1.00  0.00           H  
HETATM   45  H   UNL     1       4.295   5.267  -0.204  1.00  0.00           H  
HETATM   46  H   UNL     1       2.718   5.975  -0.627  1.00  0.00           H  
HETATM   47  HA  UNL     1       1.746   3.658  -0.675  1.00  0.00           H  
HETATM   48  H   UNL     1       5.562  -3.777   1.494  1.00  0.00           H  
HETATM   49  H   UNL     1       8.812  -3.378   1.793  1.00  0.00           H  
HETATM   50  H   UNL     1       7.967  -4.890   1.381  1.00  0.00           H  
HETATM   51  H   UNL     1       9.148  -4.192   0.247  1.00  0.00           H  
HETATM   52  H   UNL     1       6.077  -1.104  -1.817  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.993   0.721   2.014  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.609  -0.959  -0.045  1.00  0.00           H  
HETATM   55  H   UNL     1       4.504   2.863  -0.140  1.00  0.00           H  
HETATM   56  H   UNL     1       3.252   4.841   2.991  1.00  0.00           H  
CONECT    1    2    2   17   34                                       
CONECT    2    5    1    1   35                                       
CONECT    3    4   17   17   36                                       
CONECT    4   24    5    5    3                                       
CONECT    5   23    4    4    2                                       
CONECT    6    7   24   24   23                                       
CONECT    7   25    6   37   38                                       
CONECT    8   28   28   26   27                                       
CONECT    9   30   29   29   39                                       
CONECT   10   29   11   11   22                                       
CONECT   11   30   10   10   28                                       
CONECT   12   15   32   40   41                                       
CONECT   13   14   42   43   44                                       
CONECT   14   13   15   45   46                                       
CONECT   15   27   14   12   47                                       
CONECT   16   31   21   21                                            
CONECT   17    3    3    1   33                                       
CONECT   18   19   19   21   30                                       
CONECT   19   31   18   18   48                                       
CONECT   20   31   49   50   51                                       
CONECT   21   16   16   18   52                                       
CONECT   22   10   25   26   26                                       
CONECT   23    6    5   53                                            
CONECT   24    6    6    4                                            
CONECT   25   22    7   54                                            
CONECT   26   22   22    8                                            
CONECT   27    8   15   55                                            
CONECT   28   11    8    8                                            
CONECT   29    9    9   10                                            
CONECT   30   18    9   11                                            
CONECT   31   20   16   19                                            
CONECT   32   12   56                                                 
CONECT   33   17                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    9                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   23                                                      
CONECT   54   25                                                      
CONECT   55   27                                                      
CONECT   56   32                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
