COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.493   1.344  -0.200  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.851   2.632  -0.646  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.503   2.800   0.058  1.00  0.00           C  
HETATM    4  C   UNL     1       0.081   4.174  -0.279  1.00  0.00           C  
HETATM    5  N   UNL     1      -3.733   1.028  -0.624  1.00  0.00           N  
HETATM    6  C   UNL     1       1.360   4.397   0.530  1.00  0.00           C  
HETATM    7  C   UNL     1       0.444   1.724  -0.407  1.00  0.00           C  
HETATM    8  C   UNL     1       1.818   0.024  -0.491  1.00  0.00           C  
HETATM    9  C   UNL     1       1.071   0.748   0.396  1.00  0.00           C  
HETATM   10  C   UNL     1       0.947   0.550   1.885  1.00  0.00           C  
HETATM   11  C   UNL     1       2.240   0.405   2.689  1.00  0.00           C  
HETATM   12  C   UNL     1       1.416   1.690   2.791  1.00  0.00           C  
HETATM   13  O   UNL     1       2.989   6.215   0.898  1.00  0.00           O  
HETATM   14  C   UNL     1       1.870   5.794   0.288  1.00  0.00           C  
HETATM   15  O   UNL     1       1.273   6.535  -0.456  1.00  0.00           O  
HETATM   16  O   UNL     1      -1.893   0.590   0.536  1.00  0.00           O  
HETATM   17  C   UNL     1      -4.365  -0.125  -0.140  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.226  -0.843  -0.962  1.00  0.00           C  
HETATM   19 CL   UNL     1      -5.518  -0.314  -2.589  1.00  0.00          Cl  
HETATM   20  C   UNL     1      -5.848  -1.980  -0.482  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.614  -2.403   0.815  1.00  0.00           C  
HETATM   22 CL   UNL     1      -6.397  -3.832   1.415  1.00  0.00          Cl  
HETATM   23  C   UNL     1      -4.758  -1.689   1.634  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.129  -0.555   1.158  1.00  0.00           C  
HETATM   25  O   UNL     1       1.603   0.575  -1.699  1.00  0.00           O  
HETATM   26  N   UNL     1       0.840   1.510  -1.628  1.00  0.00           N  
HETATM   27  C   UNL     1       2.685  -1.135  -0.184  1.00  0.00           C  
HETATM   28  N   UNL     1       2.818  -1.737   0.974  1.00  0.00           N  
HETATM   29  O   UNL     1       3.602  -2.654   0.907  1.00  0.00           O  
HETATM   30  C   UNL     1       4.108  -2.790  -0.327  1.00  0.00           C  
HETATM   31  C   UNL     1       3.540  -1.828  -1.088  1.00  0.00           C  
HETATM   32  C   UNL     1       5.109  -3.821  -0.780  1.00  0.00           C  
HETATM   33  C   UNL     1       6.526  -3.274  -0.590  1.00  0.00           C  
HETATM   34  C   UNL     1       6.755  -2.955   0.888  1.00  0.00           C  
HETATM   35  C   UNL     1       7.543  -4.321  -1.050  1.00  0.00           C  
HETATM   36  C   UNL     1       6.695  -2.000  -1.419  1.00  0.00           C  
HETATM   37  H   UNL     1      -1.696   2.607  -1.725  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.500   3.470  -0.392  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.644   2.720   1.136  1.00  0.00           H  
HETATM   40  H   UNL     1       0.312   4.220  -1.343  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.646   4.948  -0.031  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.187   1.598  -1.263  1.00  0.00           H  
HETATM   43  H   UNL     1       1.146   4.268   1.591  1.00  0.00           H  
HETATM   44  H   UNL     1       2.116   3.675   0.222  1.00  0.00           H  
HETATM   45  H   UNL     1       0.083  -0.029   2.212  1.00  0.00           H  
HETATM   46  H   UNL     1       2.228  -0.270   3.545  1.00  0.00           H  
HETATM   47  H   UNL     1       3.181   0.452   2.141  1.00  0.00           H  
HETATM   48  H   UNL     1       1.815   2.583   2.310  1.00  0.00           H  
HETATM   49  H   UNL     1       0.862   1.861   3.714  1.00  0.00           H  
HETATM   50  H   UNL     1       3.278   7.119   0.711  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.517  -2.539  -1.120  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.577  -2.021   2.646  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.457  -0.001   1.797  1.00  0.00           H  
HETATM   54  H   UNL     1       3.700  -1.629  -2.138  1.00  0.00           H  
HETATM   55  H   UNL     1       4.989  -4.729  -0.189  1.00  0.00           H  
HETATM   56  H   UNL     1       4.946  -4.049  -1.833  1.00  0.00           H  
HETATM   57  H   UNL     1       6.635  -3.863   1.479  1.00  0.00           H  
HETATM   58  H   UNL     1       7.764  -2.565   1.023  1.00  0.00           H  
HETATM   59  H   UNL     1       6.031  -2.209   1.216  1.00  0.00           H  
HETATM   60  H   UNL     1       7.379  -4.548  -2.103  1.00  0.00           H  
HETATM   61  H   UNL     1       8.551  -3.931  -0.915  1.00  0.00           H  
HETATM   62  H   UNL     1       7.422  -5.229  -0.459  1.00  0.00           H  
HETATM   63  H   UNL     1       5.971  -1.254  -1.092  1.00  0.00           H  
HETATM   64  H   UNL     1       7.704  -1.610  -1.284  1.00  0.00           H  
HETATM   65  H   UNL     1       6.531  -2.227  -2.473  1.00  0.00           H  
CONECT    1    2    5   16   16                                       
CONECT    2    3    1   37   38                                       
CONECT    3    4    2    7   39                                       
CONECT    4    6    3   40   41                                       
CONECT    5    1   17   42                                            
CONECT    6   14    4   43   44                                       
CONECT    7    3   26   26    9                                       
CONECT    8   25    9    9   27                                       
CONECT    9    7    8    8   10                                       
CONECT   10    9   12   11   45                                       
CONECT   11   10   12   46   47                                       
CONECT   12   10   11   48   49                                       
CONECT   13   14   50                                                 
CONECT   14   15   15   13    6                                       
CONECT   15   14   14                                                 
CONECT   16    1    1                                                 
CONECT   17    5   24   24   18                                       
CONECT   18   17   19   20   20                                       
CONECT   19   18                                                      
CONECT   20   18   18   21   51                                       
CONECT   21   23   23   20   22                                       
CONECT   22   21                                                      
CONECT   23   24   21   21   52                                       
CONECT   24   17   17   23   53                                       
CONECT   25   26    8                                                 
CONECT   26    7    7   25                                            
CONECT   27    8   28   28   31                                       
CONECT   28   27   27   29                                            
CONECT   29   28   30                                                 
CONECT   30   31   31   29   32                                       
CONECT   31   27   30   30   54                                       
CONECT   32   30   33   55   56                                       
CONECT   33   36   35   32   34                                       
CONECT   34   33   57   58   59                                       
CONECT   35   33   60   61   62                                       
CONECT   36   33   63   64   65                                       
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   20                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   31                                                      
CONECT   55   32                                                      
CONECT   56   32                                                      
CONECT   57   34                                                      
CONECT   58   34                                                      
CONECT   59   34                                                      
CONECT   60   35                                                      
CONECT   61   35                                                      
CONECT   62   35                                                      
CONECT   63   36                                                      
CONECT   64   36                                                      
CONECT   65   36                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
