COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.096  -1.099  -1.120  1.00  0.00           N  
HETATM    2  N   UNL     1      -5.476   2.468   0.233  1.00  0.00           N  
HETATM    3  C   UNL     1      -0.802  -5.939   0.352  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.602  -5.001  -0.278  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.102  -3.745  -0.566  1.00  0.00           C  
HETATM    6  C   UNL     1       0.750  -2.076  -0.528  1.00  0.00           C  
HETATM    7  C   UNL     1       2.049  -1.625  -0.236  1.00  0.00           C  
HETATM    8  C   UNL     1       4.648   2.344  -1.459  1.00  0.00           C  
HETATM    9  C   UNL     1       4.248   0.334   0.457  1.00  0.00           C  
HETATM   10  C   UNL     1       5.582   2.175  -0.420  1.00  0.00           C  
HETATM   11  C   UNL     1       7.610   2.809   0.702  1.00  0.00           C  
HETATM   12  C   UNL     1       0.615   1.301  -1.822  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.076   2.709  -0.185  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.910   3.461  -0.034  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.686   1.797  -1.246  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.031   1.493  -0.869  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.352   3.196   0.381  1.00  0.00           C  
HETATM   18  C   UNL     1       0.209  -3.424  -0.221  1.00  0.00           C  
HETATM   19  C   UNL     1       1.010  -4.371   0.412  1.00  0.00           C  
HETATM   20  C   UNL     1       0.500  -5.622   0.701  1.00  0.00           C  
HETATM   21 CL   UNL     1       1.497  -6.804   1.490  1.00  0.00          Cl  
HETATM   22 CL   UNL     1      -3.235  -5.403  -0.707  1.00  0.00          Cl  
HETATM   23  C   UNL     1       2.151  -0.338  -0.676  1.00  0.00           C  
HETATM   24  C   UNL     1       3.557   1.539  -1.528  1.00  0.00           C  
HETATM   25  C   UNL     1       3.345   0.529  -0.574  1.00  0.00           C  
HETATM   26  C   UNL     1       5.380   1.159   0.549  1.00  0.00           C  
HETATM   27  C   UNL     1       6.715   2.999  -0.326  1.00  0.00           C  
HETATM   28  C   UNL     1       7.406   1.802   1.650  1.00  0.00           C  
HETATM   29  C   UNL     1       6.318   0.990   1.583  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.837   1.044  -1.395  1.00  0.00           C  
HETATM   31  N   UNL     1       0.951   0.005  -1.226  1.00  0.00           N  
HETATM   32  O   UNL     1       8.708   3.605   0.793  1.00  0.00           O  
HETATM   33  C   UNL     1       9.599   3.359   1.883  1.00  0.00           C  
HETATM   34  O   UNL     1      -4.387   4.254   0.979  1.00  0.00           O  
HETATM   35  C   UNL     1      -6.741   2.951   0.793  1.00  0.00           C  
HETATM   36  C   UNL     1      -7.852   1.944   0.487  1.00  0.00           C  
HETATM   37  C   UNL     1      -9.152   2.441   1.064  1.00  0.00           C  
HETATM   38  O   UNL     1     -10.272   1.716   0.916  1.00  0.00           O  
HETATM   39  O   UNL     1      -9.187   3.492   1.659  1.00  0.00           O  
HETATM   40  C   UNL     1       0.474   1.143  -3.338  1.00  0.00           C  
HETATM   41  C   UNL     1      -0.722   3.001  -0.564  1.00  0.00           C  
HETATM   42  H   UNL     1      -5.448   1.625  -0.245  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.196  -6.919   0.575  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.727  -3.014  -1.058  1.00  0.00           H  
HETATM   45  H   UNL     1       2.826  -2.196   0.249  1.00  0.00           H  
HETATM   46  H   UNL     1       4.798   3.116  -2.199  1.00  0.00           H  
HETATM   47  H   UNL     1       4.083  -0.446   1.185  1.00  0.00           H  
HETATM   48  H   UNL     1       1.406   2.017  -1.604  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.937   4.401   0.497  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.929   0.904  -0.985  1.00  0.00           H  
HETATM   51  H   UNL     1       2.027  -4.127   0.680  1.00  0.00           H  
HETATM   52  H   UNL     1       2.842   1.678  -2.325  1.00  0.00           H  
HETATM   53  H   UNL     1       6.884   3.777  -1.056  1.00  0.00           H  
HETATM   54  H   UNL     1       8.121   1.669   2.449  1.00  0.00           H  
HETATM   55  H   UNL     1       6.174   0.216   2.322  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.802   0.106  -1.928  1.00  0.00           H  
HETATM   57  H   UNL     1       9.066   3.485   2.825  1.00  0.00           H  
HETATM   58  H   UNL     1       9.982   2.340   1.816  1.00  0.00           H  
HETATM   59  H   UNL     1      10.431   4.062   1.838  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.640   3.063   1.873  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.991   3.914   0.350  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.952   1.832  -0.593  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.602   0.981   0.931  1.00  0.00           H  
HETATM   64  H   UNL     1     -11.082   2.075   1.304  1.00  0.00           H  
HETATM   65  H   UNL     1       0.224   2.107  -3.782  1.00  0.00           H  
HETATM   66  H   UNL     1       1.415   0.784  -3.755  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.318   0.426  -3.556  1.00  0.00           H  
HETATM   68  H   UNL     1       0.180   3.584  -0.452  1.00  0.00           H  
CONECT    1    6    6   31                                            
CONECT    2   17   35   42                                            
CONECT    3   20    4    4   43                                       
CONECT    4    3    3    5   22                                       
CONECT    5   18   18    4   44                                       
CONECT    6   18    1    1    7                                       
CONECT    7    6   23   23   45                                       
CONECT    8   24   24   10   46                                       
CONECT    9   25   25   26   47                                       
CONECT   10   26    8   27   27                                       
CONECT   11   28   28   27   32                                       
CONECT   12   40   31   15   48                                       
CONECT   13   14   14   16   17                                       
CONECT   14   41   13   13   49                                       
CONECT   15   12   41   41   30                                       
CONECT   16   30   30   13   50                                       
CONECT   17   13    2   34   34                                       
CONECT   18   19    6    5    5                                       
CONECT   19   20   20   18   51                                       
CONECT   20   21   19   19    3                                       
CONECT   21   20                                                      
CONECT   22    4                                                      
CONECT   23   31    7    7   25                                       
CONECT   24   25    8    8   52                                       
CONECT   25   23    9    9   24                                       
CONECT   26    9   29   29   10                                       
CONECT   27   10   10   11   53                                       
CONECT   28   29   11   11   54                                       
CONECT   29   26   26   28   55                                       
CONECT   30   15   16   16   56                                       
CONECT   31    1   12   23                                            
CONECT   32   11   33                                                 
CONECT   33   32   57   58   59                                       
CONECT   34   17   17                                                 
CONECT   35    2   36   60   61                                       
CONECT   36   35   37   62   63                                       
CONECT   37   36   39   39   38                                       
CONECT   38   37   64                                                 
CONECT   39   37   37                                                 
CONECT   40   12   65   66   67                                       
CONECT   41   15   15   14   68                                       
CONECT   42    2                                                      
CONECT   43    3                                                      
CONECT   44    5                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48   12                                                      
CONECT   49   14                                                      
CONECT   50   16                                                      
CONECT   51   19                                                      
CONECT   52   24                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   33                                                      
CONECT   58   33                                                      
CONECT   59   33                                                      
CONECT   60   35                                                      
CONECT   61   35                                                      
CONECT   62   36                                                      
CONECT   63   36                                                      
CONECT   64   38                                                      
CONECT   65   40                                                      
CONECT   66   40                                                      
CONECT   67   40                                                      
CONECT   68   41                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
