COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.094   1.557   0.220  1.00  0.00           C  
HETATM    2  O   UNL     1       8.447   0.284   0.161  1.00  0.00           O  
HETATM    3  C   UNL     1       7.088   0.283   0.137  1.00  0.00           C  
HETATM    4  C   UNL     1       6.413   1.469   0.163  1.00  0.00           C  
HETATM    5  C   UNL     1       6.399  -0.937   0.080  1.00  0.00           C  
HETATM    6  O   UNL     1       7.096  -2.104   0.051  1.00  0.00           O  
HETATM    7  C   UNL     1       6.336  -3.313  -0.007  1.00  0.00           C  
HETATM    8  C   UNL     1       5.035  -0.965   0.055  1.00  0.00           C  
HETATM    9  C   UNL     1       4.315   0.240   0.085  1.00  0.00           C  
HETATM   10  C   UNL     1       5.009   1.473   0.138  1.00  0.00           C  
HETATM   11  N   UNL     1       4.325   2.623   0.163  1.00  0.00           N  
HETATM   12  C   UNL     1       3.012   2.644   0.140  1.00  0.00           C  
HETATM   13  C   UNL     1       2.262   1.477   0.089  1.00  0.00           C  
HETATM   14  C   UNL     1       2.902   0.250   0.061  1.00  0.00           C  
HETATM   15  O   UNL     1       2.196  -0.906   0.010  1.00  0.00           O  
HETATM   16  C   UNL     1       0.841  -0.830   0.087  1.00  0.00           C  
HETATM   17  C   UNL     1       0.111  -0.418  -1.013  1.00  0.00           C  
HETATM   18  C   UNL     1       0.193  -1.171   1.270  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.181  -1.099   1.360  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.926  -0.683   0.268  1.00  0.00           C  
HETATM   21  O   UNL     1      -3.250  -0.511   0.049  1.00  0.00           O  
HETATM   22  C   UNL     1      -1.280  -0.341  -0.930  1.00  0.00           C  
HETATM   23  N   UNL     1      -2.254   0.018  -1.810  1.00  0.00           N  
HETATM   24  C   UNL     1      -3.415  -0.082  -1.214  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.630   0.201  -1.800  1.00  0.00           N  
HETATM   26  C   UNL     1      -5.797   0.192  -1.029  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.732   0.442   0.336  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.886   0.432   1.094  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.106   0.172   0.496  1.00  0.00           C  
HETATM   30 CL   UNL     1      -9.555   0.160   1.453  1.00  0.00          Cl  
HETATM   31  C   UNL     1      -8.174  -0.077  -0.864  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.024  -0.062  -1.628  1.00  0.00           C  
HETATM   33  H   UNL     1       8.816   2.146  -0.655  1.00  0.00           H  
HETATM   34  H   UNL     1       8.784   2.081   1.124  1.00  0.00           H  
HETATM   35  H   UNL     1      10.174   1.416   0.234  1.00  0.00           H  
HETATM   36  H   UNL     1       6.957   2.401   0.203  1.00  0.00           H  
HETATM   37  H   UNL     1       5.691  -3.379   0.869  1.00  0.00           H  
HETATM   38  H   UNL     1       5.724  -3.315  -0.909  1.00  0.00           H  
HETATM   39  H   UNL     1       7.013  -4.167  -0.025  1.00  0.00           H  
HETATM   40  H   UNL     1       4.511  -1.909   0.010  1.00  0.00           H  
HETATM   41  H   UNL     1       2.502   3.596   0.162  1.00  0.00           H  
HETATM   42  H   UNL     1       1.183   1.526   0.072  1.00  0.00           H  
HETATM   43  H   UNL     1       0.615  -0.157  -1.931  1.00  0.00           H  
HETATM   44  H   UNL     1       0.770  -1.496   2.123  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.678  -1.366   2.281  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.676   0.407  -2.747  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.779   0.644   0.803  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.835   0.626   2.155  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.128  -0.279  -1.328  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.078  -0.257  -2.689  1.00  0.00           H  
CONECT    1    2   33   34   35                                       
CONECT    2    1    3                                                 
CONECT    3    2    4    4    5                                       
CONECT    4    3    3   10   36                                       
CONECT    5    3    8    8    6                                       
CONECT    6    5    7                                                 
CONECT    7    6   37   38   39                                       
CONECT    8    5    5    9   40                                       
CONECT    9    8   14   14   10                                       
CONECT   10    4    9   11   11                                       
CONECT   11   10   10   12                                            
CONECT   12   11   13   13   41                                       
CONECT   13   12   12   14   42                                       
CONECT   14    9    9   13   15                                       
CONECT   15   14   16                                                 
CONECT   16   15   17   17   18                                       
CONECT   17   16   16   22   43                                       
CONECT   18   16   19   19   44                                       
CONECT   19   18   18   20   45                                       
CONECT   20   19   22   22   21                                       
CONECT   21   20   24                                                 
CONECT   22   17   20   20   23                                       
CONECT   23   22   24   24                                            
CONECT   24   21   23   23   25                                       
CONECT   25   24   26   46                                            
CONECT   26   25   27   27   32                                       
CONECT   27   26   26   28   47                                       
CONECT   28   27   29   29   48                                       
CONECT   29   28   28   30   31                                       
CONECT   30   29                                                      
CONECT   31   29   32   32   49                                       
CONECT   32   26   31   31   50                                       
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    4                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   25                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   31                                                      
CONECT   50   32                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
