COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.444  -0.777   0.236  1.00  0.00           C  
HETATM    2  C   UNL     1       5.066  -0.947   0.249  1.00  0.00           C  
HETATM    3  C   UNL     1       4.245   0.012  -0.316  1.00  0.00           C  
HETATM    4  C   UNL     1       4.794   1.141  -0.894  1.00  0.00           C  
HETATM    5  C   UNL     1       6.172   1.315  -0.909  1.00  0.00           C  
HETATM    6  C   UNL     1       6.996   0.357  -0.338  1.00  0.00           C  
HETATM    7  O   UNL     1       7.251  -1.720   0.791  1.00  0.00           O  
HETATM    8  O   UNL     1       6.711   2.425  -1.477  1.00  0.00           O  
HETATM    9  C   UNL     1       8.659  -1.480   0.741  1.00  0.00           C  
HETATM   10  C   UNL     1       8.136   2.538  -1.456  1.00  0.00           C  
HETATM   11 CL   UNL     1       4.374  -2.364   0.974  1.00  0.00          Cl  
HETATM   12 CL   UNL     1       3.761   2.343  -1.602  1.00  0.00          Cl  
HETATM   13  C   UNL     1       2.750  -0.175  -0.301  1.00  0.00           C  
HETATM   14  O   UNL     1       2.209   0.405   0.887  1.00  0.00           O  
HETATM   15  C   UNL     1       0.862   0.322   1.057  1.00  0.00           C  
HETATM   16  C   UNL     1       0.253   0.860   2.185  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.060   0.762   2.317  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.791   0.161   1.391  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.245  -0.363   0.304  1.00  0.00           N  
HETATM   20  C   UNL     1       0.061  -0.297   0.104  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.165   0.077   1.563  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.969  -0.448   0.543  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.995   0.321  -0.005  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.787  -0.203  -1.015  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.558  -1.487  -1.477  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.540  -2.251  -0.934  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.742  -1.733   0.070  1.00  0.00           C  
HETATM   28  N   UNL     1      -5.225   1.621   0.465  1.00  0.00           N  
HETATM   29  C   UNL     1      -6.481   2.108   0.512  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.742   3.463   1.118  1.00  0.00           C  
HETATM   31  C   UNL     1      -8.239   3.774   1.047  1.00  0.00           C  
HETATM   32  O   UNL     1      -7.402   1.455   0.067  1.00  0.00           O  
HETATM   33 CL   UNL     1      -2.461  -2.692   0.743  1.00  0.00          Cl  
HETATM   34 CL   UNL     1      -6.551  -2.141  -2.742  1.00  0.00          Cl  
HETATM   35  H   UNL     1       8.068   0.491  -0.349  1.00  0.00           H  
HETATM   36  H   UNL     1       8.977  -1.397  -0.298  1.00  0.00           H  
HETATM   37  H   UNL     1       8.888  -0.553   1.266  1.00  0.00           H  
HETATM   38  H   UNL     1       9.185  -2.307   1.217  1.00  0.00           H  
HETATM   39  H   UNL     1       8.434   3.468  -1.941  1.00  0.00           H  
HETATM   40  H   UNL     1       8.485   2.538  -0.424  1.00  0.00           H  
HETATM   41  H   UNL     1       8.575   1.694  -1.988  1.00  0.00           H  
HETATM   42  H   UNL     1       2.314   0.312  -1.174  1.00  0.00           H  
HETATM   43  H   UNL     1       2.516  -1.239  -0.325  1.00  0.00           H  
HETATM   44  H   UNL     1       0.843   1.352   2.944  1.00  0.00           H  
HETATM   45  H   UNL     1       0.501  -0.725  -0.785  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.569   0.382   2.391  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.582   0.390  -1.441  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.366  -3.253  -1.298  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.481   2.171   0.756  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.420   3.463   2.160  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.187   4.221   0.566  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.794   3.015   1.599  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.427   4.753   1.485  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.561   3.773   0.005  1.00  0.00           H  
CONECT    1    6    6    2    7                                       
CONECT    2    3    3    1   11                                       
CONECT    3    4   13    2    2                                       
CONECT    4   12    5    5    3                                       
CONECT    5    8    4    4    6                                       
CONECT    6    5    1    1   35                                       
CONECT    7    1    9                                                 
CONECT    8   10    5                                                 
CONECT    9    7   36   37   38                                       
CONECT   10    8   39   40   41                                       
CONECT   11    2                                                      
CONECT   12    4                                                      
CONECT   13   14    3   42   43                                       
CONECT   14   15   13                                                 
CONECT   15   20   14   16   16                                       
CONECT   16   15   15   17   44                                       
CONECT   17   18   18   16                                            
CONECT   18   19   21   17   17                                       
CONECT   19   20   20   18                                            
CONECT   20   19   19   15   45                                       
CONECT   21   18   22   46                                            
CONECT   22   23   21   27   27                                       
CONECT   23   28   24   24   22                                       
CONECT   24   23   23   25   47                                       
CONECT   25   24   34   26   26                                       
CONECT   26   25   25   27   48                                       
CONECT   27   22   22   26   33                                       
CONECT   28   29   23   49                                            
CONECT   29   30   32   32   28                                       
CONECT   30   31   29   50   51                                       
CONECT   31   30   52   53   54                                       
CONECT   32   29   29                                                 
CONECT   33   27                                                      
CONECT   34   25                                                      
CONECT   35    6                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   16                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   24                                                      
CONECT   48   26                                                      
CONECT   49   28                                                      
CONECT   50   30                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   31                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
