COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.116  -0.737   0.002  1.00  0.00           N  
HETATM    2  N   UNL     1       2.960  -0.478   0.001  1.00  0.00           N  
HETATM    3  C   UNL     1       0.806   0.608   0.001  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.354  -1.813   0.003  1.00  0.00           C  
HETATM    5  C   UNL     1       1.575  -0.552   0.002  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.610   1.126  -0.002  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.168   0.718   1.195  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.840  -0.509  -0.001  1.00  0.00           C  
HETATM    9  C   UNL     1       3.623   0.828  -0.001  1.00  0.00           C  
HETATM   10  C   UNL     1       5.801   0.542  -1.199  1.00  0.00           C  
HETATM   11  C   UNL     1       7.860   0.275  -0.001  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.395   2.017  -0.003  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.275  -0.111  -1.199  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.164   0.711  -1.199  1.00  0.00           C  
HETATM   15  C   UNL     1       5.117   0.633  -0.001  1.00  0.00           C  
HETATM   16  C   UNL     1       7.171   0.363  -1.202  1.00  0.00           C  
HETATM   17  C   UNL     1       7.172   0.366   1.200  1.00  0.00           C  
HETATM   18  C   UNL     1       5.802   0.545   1.197  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.150   1.168  -0.001  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.579   0.481   0.001  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.283  -0.099   1.196  1.00  0.00           C  
HETATM   22  N   UNL     1       0.962  -1.734   0.003  1.00  0.00           N  
HETATM   23  O   UNL     1      -3.240  -0.041   0.000  1.00  0.00           O  
HETATM   24  O   UNL     1       9.208   0.098  -0.001  1.00  0.00           O  
HETATM   25  S   UNL     1      -1.608   1.911  -0.002  1.00  0.00           S  
HETATM   26 CL   UNL     1      -1.105  -3.378   0.005  1.00  0.00          Cl  
HETATM   27  H   UNL     1       3.489  -1.291   0.002  1.00  0.00           H  
HETATM   28  H   UNL     1       1.272   1.582   0.000  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.733   1.038   2.130  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.709  -1.151  -0.001  1.00  0.00           H  
HETATM   31  H   UNL     1       3.329   1.384  -0.891  1.00  0.00           H  
HETATM   32  H   UNL     1       3.330   1.386   0.889  1.00  0.00           H  
HETATM   33  H   UNL     1       5.264   0.606  -2.133  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.406   2.645  -0.893  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.406   2.647   0.887  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.711  -0.431  -2.134  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.728   1.030  -2.135  1.00  0.00           H  
HETATM   38  H   UNL     1       7.705   0.292  -2.138  1.00  0.00           H  
HETATM   39  H   UNL     1       7.706   0.298   2.136  1.00  0.00           H  
HETATM   40  H   UNL     1       5.265   0.617   2.132  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.719  -0.418   2.131  1.00  0.00           H  
HETATM   42  H   UNL     1       9.712   0.923  -0.003  1.00  0.00           H  
CONECT    1    4    4   20                                            
CONECT    2    5    9   27                                            
CONECT    3    5   20   20   28                                       
CONECT    4    1    1   22   26                                       
CONECT    5    2    3   22   22                                       
CONECT    6    7    7   12   14                                       
CONECT    7    6    6   21   29                                       
CONECT    8   13   21   21   30                                       
CONECT    9    2   15   31   32                                       
CONECT   10   15   15   16   33                                       
CONECT   11   16   16   17   24                                       
CONECT   12    6   19   34   35                                       
CONECT   13    8   14   14   36                                       
CONECT   14    6   13   13   37                                       
CONECT   15    9   10   10   18                                       
CONECT   16   10   11   11   38                                       
CONECT   17   11   18   18   39                                       
CONECT   18   15   17   17   40                                       
CONECT   19   23   23   25   12                                       
CONECT   20    1    3    3   25                                       
CONECT   21    7    8    8   41                                       
CONECT   22    4    5    5                                            
CONECT   23   19   19                                                 
CONECT   24   11   42                                                 
CONECT   25   19   20                                                 
CONECT   26    4                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   21                                                      
CONECT   42   24                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
