COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.915  -0.762   0.234  1.00  0.00           C  
HETATM    2  N   UNL     1      -3.457   1.664  -0.549  1.00  0.00           N  
HETATM    3  C   UNL     1       6.976  -1.829   1.149  1.00  0.00           C  
HETATM    4  C   UNL     1       6.178  -0.832   0.620  1.00  0.00           C  
HETATM    5  C   UNL     1       4.686  -0.870   0.832  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.182   1.952  -0.601  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.802  -0.432  -0.679  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.989  -2.323  -1.300  1.00  0.00           C  
HETATM    9  C   UNL     1       4.242   0.391   1.578  1.00  0.00           C  
HETATM   10  O   UNL     1      -9.367  -0.673   0.655  1.00  0.00           O  
HETATM   11  C   UNL     1      -8.305  -0.079   0.630  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.128  -0.644  -0.046  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.147  -1.879  -0.694  1.00  0.00           C  
HETATM   14  N   UNL     1      -4.879  -1.606  -1.276  1.00  0.00           N  
HETATM   15  N   UNL     1      -8.158   1.129   1.223  1.00  0.00           N  
HETATM   16  C   UNL     1      -6.964   1.777   1.183  1.00  0.00           C  
HETATM   17  N   UNL     1      -5.909   1.301   0.593  1.00  0.00           N  
HETATM   18  C   UNL     1      -5.930   0.102  -0.034  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.599   0.276  -0.683  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.356  -0.257  -0.817  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.467   0.761  -0.769  1.00  0.00           C  
HETATM   22  C   UNL     1       0.031   0.635  -0.878  1.00  0.00           C  
HETATM   23  C   UNL     1       0.630   0.445   0.517  1.00  0.00           C  
HETATM   24  N   UNL     1       2.090   0.322   0.411  1.00  0.00           N  
HETATM   25  C   UNL     1       2.464  -0.904  -0.306  1.00  0.00           C  
HETATM   26  C   UNL     1       3.978  -0.927  -0.525  1.00  0.00           C  
HETATM   27  C   UNL     1       2.720   0.375   1.736  1.00  0.00           C  
HETATM   28  C   UNL     1       6.746   0.195  -0.111  1.00  0.00           C  
HETATM   29  C   UNL     1       8.116   0.233  -0.300  1.00  0.00           C  
HETATM   30 CL   UNL     1       8.831   1.529  -1.207  1.00  0.00          Cl  
HETATM   31  C   UNL     1       8.345  -1.793   0.956  1.00  0.00           C  
HETATM   32  H   UNL     1       9.984  -0.735   0.083  1.00  0.00           H  
HETATM   33  H   UNL     1       6.531  -2.635   1.713  1.00  0.00           H  
HETATM   34  H   UNL     1       4.424  -1.751   1.418  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.754   2.941  -0.527  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.991  -3.278  -1.805  1.00  0.00           H  
HETATM   37  H   UNL     1       4.710   0.415   2.562  1.00  0.00           H  
HETATM   38  H   UNL     1       4.540   1.273   1.011  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.047  -2.474  -0.722  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.911   1.536   1.679  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.888   2.739   1.668  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.121  -1.304  -0.939  1.00  0.00           H  
HETATM   43  H   UNL     1       0.279  -0.225  -1.500  1.00  0.00           H  
HETATM   44  H   UNL     1       0.440   1.539  -1.329  1.00  0.00           H  
HETATM   45  H   UNL     1       0.382   1.305   1.139  1.00  0.00           H  
HETATM   46  H   UNL     1       0.221  -0.460   0.967  1.00  0.00           H  
HETATM   47  H   UNL     1       2.169  -1.773   0.282  1.00  0.00           H  
HETATM   48  H   UNL     1       1.957  -0.930  -1.271  1.00  0.00           H  
HETATM   49  H   UNL     1       4.272  -0.066  -1.125  1.00  0.00           H  
HETATM   50  H   UNL     1       4.257  -1.844  -1.043  1.00  0.00           H  
HETATM   51  H   UNL     1       2.424  -0.500   2.315  1.00  0.00           H  
HETATM   52  H   UNL     1       2.399   1.279   2.254  1.00  0.00           H  
HETATM   53  H   UNL     1       6.121   0.969  -0.531  1.00  0.00           H  
HETATM   54  H   UNL     1       8.969  -2.572   1.369  1.00  0.00           H  
CONECT    1   29   31   31   32                                       
CONECT    2    6    6   19                                            
CONECT    3    4    4   31   33                                       
CONECT    4   28    5    3    3                                       
CONECT    5   26    4    9   34                                       
CONECT    6    2    2   21   35                                       
CONECT    7   19   14   14   18                                       
CONECT    8   14   13   13   36                                       
CONECT    9    5   27   37   38                                       
CONECT   10   11   11                                                 
CONECT   11   12   15   10   10                                       
CONECT   12   18   18   13   11                                       
CONECT   13    8    8   12   39                                       
CONECT   14    7    7    8                                            
CONECT   15   16   11   40                                            
CONECT   16   17   17   15   41                                       
CONECT   17   18   16   16                                            
CONECT   18    7   17   12   12                                       
CONECT   19    2   20    7                                            
CONECT   20   21   21   19   42                                       
CONECT   21    6   22   20   20                                       
CONECT   22   21   23   43   44                                       
CONECT   23   22   24   45   46                                       
CONECT   24   25   23   27                                            
CONECT   25   26   24   47   48                                       
CONECT   26   25    5   49   50                                       
CONECT   27   24    9   51   52                                       
CONECT   28   29   29    4   53                                       
CONECT   29   30   28   28    1                                       
CONECT   30   29                                                      
CONECT   31    1    1    3   54                                       
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   20                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
