COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.813   1.389  -0.618  1.00  0.00           C  
HETATM    2  C   UNL     1       3.479   0.164  -0.435  1.00  0.00           C  
HETATM    3  C   UNL     1       2.958  -0.780   0.486  1.00  0.00           C  
HETATM    4  C   UNL     1       1.787  -0.475   1.200  1.00  0.00           C  
HETATM    5  C   UNL     1       1.165   0.725   0.998  1.00  0.00           C  
HETATM    6  C   UNL     1       1.679   1.655   0.089  1.00  0.00           C  
HETATM    7  C   UNL     1       4.651  -0.135  -1.153  1.00  0.00           C  
HETATM    8  C   UNL     1       5.279  -1.324  -0.963  1.00  0.00           C  
HETATM    9  C   UNL     1       4.773  -2.270  -0.052  1.00  0.00           C  
HETATM   10  C   UNL     1       3.621  -2.004   0.670  1.00  0.00           C  
HETATM   11  C   UNL     1       5.453  -3.516   0.129  1.00  0.00           C  
HETATM   12  N   UNL     1       5.993  -4.505   0.274  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.633  -1.901  -0.375  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.207   3.374   0.037  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.756   1.167  -1.426  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.905  -0.193  -2.111  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.803  -1.306  -1.077  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.558  -2.940   0.574  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.152  -2.791   0.498  1.00  0.00           C  
HETATM   20  N   UNL     1      -3.469  -1.158  -1.163  1.00  0.00           N  
HETATM   21  N   UNL     1      -5.348  -2.185  -0.216  1.00  0.00           N  
HETATM   22  O   UNL     1       0.032   1.018   1.688  1.00  0.00           O  
HETATM   23  O   UNL     1      -1.796   1.067  -0.372  1.00  0.00           O  
HETATM   24  O   UNL     1      -5.528  -0.635  -1.787  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.050  -3.737   1.354  1.00  0.00           O  
HETATM   26  C   UNL     1      -1.949   4.521   0.764  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.031   4.497   1.798  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.367   3.325   2.109  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.621   2.171   1.384  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.545   2.196   0.343  1.00  0.00           C  
HETATM   31  C   UNL     1       1.219  -1.467   2.182  1.00  0.00           C  
HETATM   32 CL   UNL     1       3.437   2.562  -1.735  1.00  0.00          Cl  
HETATM   33  H   UNL     1       1.171   2.597  -0.054  1.00  0.00           H  
HETATM   34  H   UNL     1       5.052   0.580  -1.855  1.00  0.00           H  
HETATM   35  H   UNL     1       6.178  -1.546  -1.518  1.00  0.00           H  
HETATM   36  H   UNL     1       3.236  -2.732   1.368  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.563  -1.774  -0.447  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.927   3.395  -0.767  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.421   1.906  -2.154  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.718   1.473  -1.014  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.569  -0.097  -2.970  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.927  -0.540  -2.445  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.504  -3.381   1.129  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.312  -2.279  -0.166  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.466   5.439   0.524  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.833   5.395   2.364  1.00  0.00           H  
HETATM   47  H   UNL     1       0.350   3.308   2.917  1.00  0.00           H  
HETATM   48  H   UNL     1       1.647  -1.287   3.168  1.00  0.00           H  
HETATM   49  H   UNL     1       0.136  -1.351   2.230  1.00  0.00           H  
HETATM   50  H   UNL     1       1.462  -2.479   1.859  1.00  0.00           H  
CONECT    1    6   32    2    2                                       
CONECT    2    1    1    3    7                                       
CONECT    3    4    4    2   10                                       
CONECT    4    5   31    3    3                                       
CONECT    5   22    6    6    4                                       
CONECT    6    5    5    1   33                                       
CONECT    7    2    8    8   34                                       
CONECT    8    7    7    9   35                                       
CONECT    9   10   10    8   11                                       
CONECT   10    3    9    9   36                                       
CONECT   11    9   12   12   12                                       
CONECT   12   11   11   11                                            
CONECT   13   20   19   19   37                                       
CONECT   14   30   30   26   38                                       
CONECT   15   16   23   39   40                                       
CONECT   16   15   20   41   42                                       
CONECT   17   24   24   20   21                                       
CONECT   18   21   19   25   25                                       
CONECT   19   13   13   18   43                                       
CONECT   20   16   17   13                                            
CONECT   21   17   18   44                                            
CONECT   22   29    5                                                 
CONECT   23   15   30                                                 
CONECT   24   17   17                                                 
CONECT   25   18   18                                                 
CONECT   26   14   27   27   45                                       
CONECT   27   26   26   28   46                                       
CONECT   28   29   29   27   47                                       
CONECT   29   30   22   28   28                                       
CONECT   30   23   14   14   29                                       
CONECT   31    4   48   49   50                                       
CONECT   32    1                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   19                                                      
CONECT   44   21                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   31                                                      
CONECT   49   31                                                      
CONECT   50   31                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
