COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.605   2.042   0.077  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.209   2.122  -0.083  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.647   3.351  -0.463  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.460   4.385  -0.656  1.00  0.00           N  
HETATM    5  N   UNL     1      -3.336   3.136  -0.135  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.766   4.265  -0.494  1.00  0.00           C  
HETATM    7  C   UNL     1       7.630   0.587  -1.670  1.00  0.00           C  
HETATM    8  C   UNL     1       8.853  -1.523   0.984  1.00  0.00           C  
HETATM    9  C   UNL     1       1.719   1.212   0.737  1.00  0.00           C  
HETATM   10  C   UNL     1       3.045   0.830   0.705  1.00  0.00           C  
HETATM   11  C   UNL     1       9.038  -0.921  -0.206  1.00  0.00           C  
HETATM   12  C   UNL     1       1.111  -0.828  -0.401  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.702  -0.801   2.451  1.00  0.00           C  
HETATM   14  C   UNL     1      -9.056  -2.401  -1.301  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.130  -2.138  -0.383  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.293  -0.282   2.155  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.023  -1.963   1.505  1.00  0.00           C  
HETATM   18  C   UNL     1       5.659   0.149   0.679  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.533  -0.915  -0.249  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.804  -1.651  -0.794  1.00  0.00           C  
HETATM   21  C   UNL     1       2.438  -1.204  -0.430  1.00  0.00           C  
HETATM   22  C   UNL     1       0.743   0.384   0.184  1.00  0.00           C  
HETATM   23  C   UNL     1       3.408  -0.376   0.123  1.00  0.00           C  
HETATM   24  C   UNL     1       7.045  -0.427   0.554  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.681   0.791   0.217  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.229   0.235   0.716  1.00  0.00           C  
HETATM   27  N   UNL     1       0.718   3.483  -0.633  1.00  0.00           N  
HETATM   28  N   UNL     1       7.627  -1.205   1.425  1.00  0.00           N  
HETATM   29  N   UNL     1      -1.702   0.024   0.521  1.00  0.00           N  
HETATM   30  N   UNL     1      -5.823  -1.514   0.121  1.00  0.00           N  
HETATM   31  N   UNL     1       7.891  -0.225  -0.480  1.00  0.00           N  
HETATM   32  N   UNL     1      -2.889   0.760   0.444  1.00  0.00           N  
HETATM   33  O   UNL     1      -6.593  -1.370  -1.958  1.00  0.00           O  
HETATM   34  O   UNL     1       4.714  -0.749   0.093  1.00  0.00           O  
HETATM   35 CL   UNL     1       2.896  -2.713  -1.156  1.00  0.00          Cl  
HETATM   36  H   UNL     1      -3.390   5.131  -0.657  1.00  0.00           H  
HETATM   37  H   UNL     1       7.179  -0.035  -2.443  1.00  0.00           H  
HETATM   38  H   UNL     1       6.949   1.399  -1.414  1.00  0.00           H  
HETATM   39  H   UNL     1       8.568   1.002  -2.039  1.00  0.00           H  
HETATM   40  H   UNL     1       9.566  -2.156   1.492  1.00  0.00           H  
HETATM   41  H   UNL     1       1.438   2.149   1.194  1.00  0.00           H  
HETATM   42  H   UNL     1       3.801   1.471   1.133  1.00  0.00           H  
HETATM   43  H   UNL     1       9.921  -0.975  -0.825  1.00  0.00           H  
HETATM   44  H   UNL     1       0.357  -1.472  -0.830  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.753  -1.147   3.483  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.424   0.001   2.300  1.00  0.00           H  
HETATM   47  H   UNL     1     -10.029  -2.758  -0.999  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.834  -2.256  -2.348  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.351  -2.282   0.664  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.053   0.529   2.843  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.574  -1.091   2.283  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.359  -2.801   1.718  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.058  -2.273   1.646  1.00  0.00           H  
HETATM   54  H   UNL     1       5.419   0.292   1.733  1.00  0.00           H  
HETATM   55  H   UNL     1       5.616   1.109   0.163  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.587  -0.533  -1.268  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.747  -1.667  -0.182  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.965   1.027   0.581  1.00  0.00           H  
HETATM   59  H   UNL     1       1.283   2.695  -0.649  1.00  0.00           H  
HETATM   60  H   UNL     1       1.111   4.364  -0.737  1.00  0.00           H  
CONECT    1    5   32    2    2                                       
CONECT    2    1    1    3   25                                       
CONECT    3    4    4    2   27                                       
CONECT    4    6    3    3                                            
CONECT    5    6    6    1                                            
CONECT    6    5    5    4   36                                       
CONECT    7   31   37   38   39                                       
CONECT    8   28   11   11   40                                       
CONECT    9   22   22   10   41                                       
CONECT   10    9   23   23   42                                       
CONECT   11    8    8   31   43                                       
CONECT   12   22   21   21   44                                       
CONECT   13   17   16   45   46                                       
CONECT   14   15   15   47   48                                       
CONECT   15   14   14   20   49                                       
CONECT   16   26   13   50   51                                       
CONECT   17   30   13   52   53                                       
CONECT   18   24   34   54   55                                       
CONECT   19   30   26   56   57                                       
CONECT   20   15   33   33   30                                       
CONECT   21   12   12   23   35                                       
CONECT   22   25    9    9   12                                       
CONECT   23   10   10   21   34                                       
CONECT   24   28   28   31   18                                       
CONECT   25    2   29   29   22                                       
CONECT   26   19   32   16   58                                       
CONECT   27    3   59   60                                            
CONECT   28    8   24   24                                            
CONECT   29   32   25   25                                            
CONECT   30   20   19   17                                            
CONECT   31   11   24    7                                            
CONECT   32   26    1   29                                            
CONECT   33   20   20                                                 
CONECT   34   23   18                                                 
CONECT   35   21                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
