COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.161  -0.105   1.608  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.086  -0.618  -0.103  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.952  -0.136   0.970  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.251   1.039   0.970  1.00  0.00           O  
HETATM    5  C   UNL     1      -6.937  -1.083  -0.594  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.460  -0.056   0.436  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.904  -1.196  -1.717  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.562  -1.644  -1.133  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.073   0.477   2.432  1.00  0.00           N  
HETATM   10  C   UNL     1      -5.119  -0.505   1.020  1.00  0.00           C  
HETATM   11  C   UNL     1       0.419  -0.739   0.422  1.00  0.00           C  
HETATM   12  O   UNL     1      -8.189  -0.664  -1.140  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.631  -0.578   1.546  1.00  0.00           C  
HETATM   14  C   UNL     1       1.610   2.284   2.213  1.00  0.00           C  
HETATM   15  C   UNL     1       0.159   2.406   4.244  1.00  0.00           C  
HETATM   16  C   UNL     1       0.942   3.226   3.217  1.00  0.00           C  
HETATM   17  C   UNL     1       2.013   4.051   3.933  1.00  0.00           C  
HETATM   18  C   UNL     1       2.616   2.010  -2.626  1.00  0.00           C  
HETATM   19  C   UNL     1       1.554   2.440  -3.397  1.00  0.00           C  
HETATM   20  C   UNL     1       2.387   1.413  -1.389  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.802  -1.047   0.456  1.00  0.00           N  
HETATM   22  C   UNL     1       2.644   0.402   0.635  1.00  0.00           C  
HETATM   23  C   UNL     1       1.171   0.596   0.398  1.00  0.00           C  
HETATM   24  C   UNL     1       1.847  -2.677  -0.268  1.00  0.00           C  
HETATM   25  C   UNL     1       3.103  -3.937   1.339  1.00  0.00           C  
HETATM   26  C   UNL     1       2.721  -3.711   0.030  1.00  0.00           C  
HETATM   27  C   UNL     1       2.614  -3.131   2.351  1.00  0.00           C  
HETATM   28  C   UNL     1       1.363  -1.868   0.745  1.00  0.00           C  
HETATM   29  C   UNL     1       0.020   1.690  -1.718  1.00  0.00           C  
HETATM   30  C   UNL     1       1.076   1.260  -0.947  1.00  0.00           C  
HETATM   31  N   UNL     1       3.279   0.902  -0.444  1.00  0.00           N  
HETATM   32  C   UNL     1       1.747  -2.096   2.054  1.00  0.00           C  
HETATM   33  C   UNL     1       0.255   2.282  -2.947  1.00  0.00           C  
HETATM   34  C   UNL     1      -0.014   4.165   2.478  1.00  0.00           C  
HETATM   35  C   UNL     1       0.538   1.460   1.497  1.00  0.00           C  
HETATM   36 CL   UNL     1       1.850   3.185  -4.937  1.00  0.00          Cl  
HETATM   37  F   UNL     1       1.473  -2.456  -1.547  1.00  0.00           F  
HETATM   38 CL   UNL     1       3.334  -4.723  -1.240  1.00  0.00          Cl  
HETATM   39  H   UNL     1      -3.966   0.352  -0.586  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.057  -2.053  -0.111  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.340   0.914  -0.047  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.196   0.024   1.236  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.243  -1.927  -2.450  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.784  -0.226  -2.199  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.826  -1.725  -1.933  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.682  -2.614  -0.650  1.00  0.00           H  
HETATM   47  H   UNL     1       0.619   0.094   3.058  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.239  -1.475   1.502  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.779   0.227   1.753  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.072  -0.918  -0.534  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.893  -0.571  -0.483  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.748  -1.512   2.094  1.00  0.00           H  
HETATM   53  H   UNL     1       2.168   2.869   1.482  1.00  0.00           H  
HETATM   54  H   UNL     1       2.291   1.616   2.740  1.00  0.00           H  
HETATM   55  H   UNL     1       0.840   1.737   4.770  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.317   3.077   4.959  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.605   1.819   3.733  1.00  0.00           H  
HETATM   58  H   UNL     1       2.571   4.635   3.202  1.00  0.00           H  
HETATM   59  H   UNL     1       1.538   4.722   4.648  1.00  0.00           H  
HETATM   60  H   UNL     1       2.694   3.382   4.460  1.00  0.00           H  
HETATM   61  H   UNL     1       3.627   2.137  -2.984  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.563  -1.987   0.456  1.00  0.00           H  
HETATM   63  H   UNL     1       3.783  -4.742   1.572  1.00  0.00           H  
HETATM   64  H   UNL     1       2.913  -3.307   3.374  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.993   1.565  -1.365  1.00  0.00           H  
HETATM   66  H   UNL     1       4.242   0.906  -0.551  1.00  0.00           H  
HETATM   67  H   UNL     1       1.366  -1.467   2.845  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.573   2.618  -3.553  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.777   3.577   1.967  1.00  0.00           H  
HETATM   70  H   UNL     1      -0.490   4.836   3.193  1.00  0.00           H  
HETATM   71  H   UNL     1       0.544   4.749   1.746  1.00  0.00           H  
HETATM   72  H   UNL     1      -0.226   2.113   1.075  1.00  0.00           H  
CONECT    1   22   22                                                 
CONECT    2   21   10    8   39                                       
CONECT    3   13   21    4    4                                       
CONECT    4    3    3                                                 
CONECT    5    6    7   12   40                                       
CONECT    6   10    5   41   42                                       
CONECT    7    8    5   43   44                                       
CONECT    8    2    7   45   46                                       
CONECT    9   35   13   47                                            
CONECT   10    2    6   48   49                                       
CONECT   11   23   28   13   50                                       
CONECT   12    5   51                                                 
CONECT   13    9   11    3   52                                       
CONECT   14   16   35   53   54                                       
CONECT   15   16   55   56   57                                       
CONECT   16   17   14   15   34                                       
CONECT   17   16   58   59   60                                       
CONECT   18   20   20   19   61                                       
CONECT   19   18   36   33   33                                       
CONECT   20   18   18   31   30                                       
CONECT   21    3    2   62                                            
CONECT   22   31    1    1   23                                       
CONECT   23   22   30   35   11                                       
CONECT   24   28   28   26   37                                       
CONECT   25   27   26   26   63                                       
CONECT   26   25   25   24   38                                       
CONECT   27   32   32   25   64                                       
CONECT   28   32   11   24   24                                       
CONECT   29   30   30   33   65                                       
CONECT   30   20   23   29   29                                       
CONECT   31   20   22   66                                            
CONECT   32   27   27   28   67                                       
CONECT   33   19   19   29   68                                       
CONECT   34   16   69   70   71                                       
CONECT   35   14   23    9   72                                       
CONECT   36   19                                                      
CONECT   37   24                                                      
CONECT   38   26                                                      
CONECT   39    2                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   11                                                      
CONECT   51   12                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   17                                                      
CONECT   59   17                                                      
CONECT   60   17                                                      
CONECT   61   18                                                      
CONECT   62   21                                                      
CONECT   63   25                                                      
CONECT   64   27                                                      
CONECT   65   29                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   33                                                      
CONECT   69   34                                                      
CONECT   70   34                                                      
CONECT   71   34                                                      
CONECT   72   35                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
