COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.425   2.701  -1.028  1.00  0.00           C  
HETATM    2  C   UNL     1       7.254   1.890   0.258  1.00  0.00           C  
HETATM    3  C   UNL     1       7.066   2.843   1.440  1.00  0.00           C  
HETATM    4  N   UNL     1       6.078   1.025   0.137  1.00  0.00           N  
HETATM    5  N   UNL     1       4.769   1.466  -0.085  1.00  0.00           N  
HETATM    6  C   UNL     1       6.091  -0.336   0.217  1.00  0.00           C  
HETATM    7  N   UNL     1       7.041  -1.251   0.409  1.00  0.00           N  
HETATM    8  C   UNL     1       6.743  -2.532   0.440  1.00  0.00           C  
HETATM    9  N   UNL     1       5.510  -2.981   0.285  1.00  0.00           N  
HETATM   10  C   UNL     1       4.494  -2.146   0.089  1.00  0.00           C  
HETATM   11  N   UNL     1       3.207  -2.622  -0.072  1.00  0.00           N  
HETATM   12  C   UNL     1       4.762  -0.768   0.048  1.00  0.00           C  
HETATM   13  C   UNL     1       3.956   0.438  -0.143  1.00  0.00           C  
HETATM   14  C   UNL     1       2.491   0.488  -0.364  1.00  0.00           C  
HETATM   15  C   UNL     1       1.654  -0.291   0.413  1.00  0.00           C  
HETATM   16  C   UNL     1       1.966   1.332  -1.357  1.00  0.00           C  
HETATM   17  C   UNL     1       0.628   1.397  -1.578  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.252   0.613  -0.808  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.639   0.664  -1.019  1.00  0.00           C  
HETATM   20  C   UNL     1       0.268  -0.239   0.200  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.614  -1.017   0.971  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.953  -0.948   0.746  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.472  -0.115  -0.250  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.815  -0.066  -0.452  1.00  0.00           O  
HETATM   25  C   UNL     1      -4.627  -0.898   0.378  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.077  -0.712   0.012  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.828   0.263   0.640  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.159   0.434   0.303  1.00  0.00           C  
HETATM   29 CL   UNL     1      -9.104   1.659   1.092  1.00  0.00          Cl  
HETATM   30  C   UNL     1      -8.737  -0.370  -0.662  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.984  -1.345  -1.290  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.653  -1.512  -0.957  1.00  0.00           C  
HETATM   33  H   UNL     1       6.538   3.313  -1.193  1.00  0.00           H  
HETATM   34  H   UNL     1       8.300   3.345  -0.938  1.00  0.00           H  
HETATM   35  H   UNL     1       7.559   2.022  -1.870  1.00  0.00           H  
HETATM   36  H   UNL     1       8.141   1.278   0.422  1.00  0.00           H  
HETATM   37  H   UNL     1       6.179   3.456   1.276  1.00  0.00           H  
HETATM   38  H   UNL     1       6.944   2.266   2.356  1.00  0.00           H  
HETATM   39  H   UNL     1       7.941   3.488   1.530  1.00  0.00           H  
HETATM   40  H   UNL     1       7.538  -3.245   0.597  1.00  0.00           H  
HETATM   41  H   UNL     1       2.989  -3.529   0.195  1.00  0.00           H  
HETATM   42  H   UNL     1       2.522  -2.050  -0.451  1.00  0.00           H  
HETATM   43  H   UNL     1       2.063  -0.935   1.177  1.00  0.00           H  
HETATM   44  H   UNL     1       2.634   1.937  -1.951  1.00  0.00           H  
HETATM   45  H   UNL     1       0.238   2.051  -2.344  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.049   1.311  -1.780  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.228  -1.669   1.741  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.625  -1.549   1.342  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.347  -1.941   0.233  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.478  -0.625   1.423  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.377   0.891   1.394  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.776  -0.237  -0.925  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.435  -1.973  -2.044  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.064  -2.270  -1.451  1.00  0.00           H  
CONECT    1    2   33   34   35                                       
CONECT    2    3    4    1   36                                       
CONECT    3    2   37   38   39                                       
CONECT    4    2    6    5                                            
CONECT    5    4   13   13                                            
CONECT    6    7    4   12   12                                       
CONECT    7    8    8    6                                            
CONECT    8    7    7    9   40                                       
CONECT    9    8   10   10                                            
CONECT   10    9    9   12   11                                       
CONECT   11   10   41   42                                            
CONECT   12    6    6   10   13                                       
CONECT   13    5    5   12   14                                       
CONECT   14   16   13   15   15                                       
CONECT   15   14   14   20   43                                       
CONECT   16   17   17   14   44                                       
CONECT   17   16   16   18   45                                       
CONECT   18   17   19   19   20                                       
CONECT   19   18   18   23   46                                       
CONECT   20   18   15   21   21                                       
CONECT   21   20   20   22   47                                       
CONECT   22   23   23   21   48                                       
CONECT   23   19   24   22   22                                       
CONECT   24   25   23                                                 
CONECT   25   26   24   49   50                                       
CONECT   26   27   27   25   32                                       
CONECT   27   26   26   28   51                                       
CONECT   28   29   27   30   30                                       
CONECT   29   28                                                      
CONECT   30   28   28   31   52                                       
CONECT   31   32   32   30   53                                       
CONECT   32   26   31   31   54                                       
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    8                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
CONECT   52   30                                                      
CONECT   53   31                                                      
CONECT   54   32                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
