COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.722   2.037  -1.174  1.00  0.00           C  
HETATM    2  C   UNL     1       2.497  -0.465  -1.057  1.00  0.00           C  
HETATM    3  C   UNL     1       1.090  -0.537  -1.590  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.247  -0.399  -0.973  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.650  -0.251  -0.304  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.931  -0.064   0.607  1.00  0.00           C  
HETATM    7  C   UNL     1      -8.078   0.023   0.982  1.00  0.00           C  
HETATM    8  C   UNL     1      -9.371   0.127   1.502  1.00  0.00           C  
HETATM    9  C   UNL     1     -10.278  -0.244  -0.688  1.00  0.00           C  
HETATM   10  C   UNL     1      -9.008  -0.349  -1.217  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.903  -0.217  -0.391  1.00  0.00           C  
HETATM   12  C   UNL     1       3.239  -1.523  -0.693  1.00  0.00           C  
HETATM   13  C   UNL     1       4.531  -1.005  -0.239  1.00  0.00           C  
HETATM   14  C   UNL     1       5.697  -1.599   0.252  1.00  0.00           C  
HETATM   15  C   UNL     1       6.763  -0.817   0.600  1.00  0.00           C  
HETATM   16  C   UNL     1       6.695   0.565   0.470  1.00  0.00           C  
HETATM   17  C   UNL     1       4.458   0.393  -0.372  1.00  0.00           C  
HETATM   18 CL   UNL     1       8.061   1.538   0.919  1.00  0.00          Cl  
HETATM   19 CL   UNL     1       5.792  -3.324   0.419  1.00  0.00          Cl  
HETATM   20  C   UNL     1       5.555   1.171  -0.012  1.00  0.00           C  
HETATM   21  N   UNL     1       3.212   0.689  -0.877  1.00  0.00           N  
HETATM   22  C   UNL     1       2.037   2.616   0.065  1.00  0.00           C  
HETATM   23  O   UNL     1       1.560   3.931  -0.225  1.00  0.00           O  
HETATM   24  N   UNL     1       0.138  -0.335  -0.489  1.00  0.00           N  
HETATM   25  C   UNL     1      -2.207  -0.185   0.200  1.00  0.00           C  
HETATM   26  N   UNL     1      -4.569  -0.047   0.819  1.00  0.00           N  
HETATM   27  N   UNL     1      -6.535  -0.268  -0.601  1.00  0.00           N  
HETATM   28  N   UNL     1      -6.839   0.106   1.535  1.00  0.00           N  
HETATM   29  C   UNL     1     -10.457  -0.007   0.667  1.00  0.00           C  
HETATM   30  H   UNL     1       3.561   2.674  -1.457  1.00  0.00           H  
HETATM   31  H   UNL     1       2.008   1.991  -1.996  1.00  0.00           H  
HETATM   32  H   UNL     1       0.946   0.240  -2.341  1.00  0.00           H  
HETATM   33  H   UNL     1       0.922  -1.515  -2.042  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.408   0.379  -1.720  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.432  -1.376  -1.420  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.810   0.526  -1.051  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.835  -1.228  -0.751  1.00  0.00           H  
HETATM   38  H   UNL     1      -9.517   0.311   2.556  1.00  0.00           H  
HETATM   39  H   UNL     1     -11.138  -0.347  -1.332  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.876  -0.534  -2.273  1.00  0.00           H  
HETATM   41  H   UNL     1       2.939  -2.560  -0.729  1.00  0.00           H  
HETATM   42  H   UNL     1       7.664  -1.276   0.979  1.00  0.00           H  
HETATM   43  H   UNL     1       5.512   2.246  -0.109  1.00  0.00           H  
HETATM   44  H   UNL     1       1.199   1.979   0.348  1.00  0.00           H  
HETATM   45  H   UNL     1       2.752   2.662   0.887  1.00  0.00           H  
HETATM   46  H   UNL     1       1.113   4.360   0.518  1.00  0.00           H  
HETATM   47  H   UNL     1       0.294  -1.004   0.250  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.047  -0.963   0.947  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.022   0.792   0.647  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.219   0.101   1.711  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.088  -0.420  -1.449  1.00  0.00           H  
HETATM   52  H   UNL     1     -11.456   0.073   1.070  1.00  0.00           H  
CONECT    1   21   22   30   31                                       
CONECT    2   12   12    3   21                                       
CONECT    3    2   24   32   33                                       
CONECT    4   24   25   34   35                                       
CONECT    5   25   26   36   37                                       
CONECT    6   26   28   28   27                                       
CONECT    7   28   11   11    8                                       
CONECT    8    7   29   29   38                                       
CONECT    9   10   10   29   39                                       
CONECT   10   11    9    9   40                                       
CONECT   11   27    7    7   10                                       
CONECT   12   13    2    2   41                                       
CONECT   13   14   12   17   17                                       
CONECT   14   19   15   15   13                                       
CONECT   15   14   14   16   42                                       
CONECT   16   15   18   20   20                                       
CONECT   17   13   13   20   21                                       
CONECT   18   16                                                      
CONECT   19   14                                                      
CONECT   20   16   16   17   43                                       
CONECT   21    2   17    1                                            
CONECT   22    1   23   44   45                                       
CONECT   23   22   46                                                 
CONECT   24    3    4   47                                            
CONECT   25    4    5   48   49                                       
CONECT   26    5    6   50                                            
CONECT   27    6   11   51                                            
CONECT   28    6    6    7                                            
CONECT   29    8    8    9   52                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   15                                                      
CONECT   43   20                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   29                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
