COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.553   0.216  -1.349  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.234  -1.593  -1.380  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.655  -0.514  -0.004  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.978   1.213   0.159  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.539  -0.896   0.714  1.00  0.00           C  
HETATM    6  C   UNL     1       7.264   2.604  -0.569  1.00  0.00           C  
HETATM    7  C   UNL     1       6.285   1.387   1.281  1.00  0.00           C  
HETATM    8  C   UNL     1       4.882   2.173  -0.529  1.00  0.00           C  
HETATM    9  C   UNL     1       3.855   1.090  -0.321  1.00  0.00           C  
HETATM   10  C   UNL     1       3.215   0.970   0.899  1.00  0.00           C  
HETATM   11  C   UNL     1       2.273  -0.024   1.090  1.00  0.00           C  
HETATM   12  C   UNL     1       1.971  -0.897   0.062  1.00  0.00           C  
HETATM   13  C   UNL     1       2.611  -0.777  -1.158  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.434  -0.988  -1.375  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.827   0.210   0.503  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.846   0.514  -0.331  1.00  0.00           C  
HETATM   17  N   UNL     1       6.210   1.666  -0.160  1.00  0.00           N  
HETATM   18  N   UNL     1      -0.700  -1.536  -0.125  1.00  0.00           N  
HETATM   19  N   UNL     1      -6.995   1.516  -0.672  1.00  0.00           N  
HETATM   20  O   UNL     1       1.065  -3.183  -0.640  1.00  0.00           O  
HETATM   21  O   UNL     1       0.713  -2.397   1.706  1.00  0.00           O  
HETATM   22  O   UNL     1      -6.031   1.539   1.331  1.00  0.00           O  
HETATM   23  O   UNL     1      -8.125   2.214  -0.183  1.00  0.00           O  
HETATM   24  S   UNL     1       0.771  -2.164   0.306  1.00  0.00           S  
HETATM   25  H   UNL     1       4.050   0.313  -2.303  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.768  -2.055  -2.238  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.368  -0.714   1.764  1.00  0.00           H  
HETATM   28  H   UNL     1       8.237   2.205  -0.283  1.00  0.00           H  
HETATM   29  H   UNL     1       7.230   2.739  -1.650  1.00  0.00           H  
HETATM   30  H   UNL     1       7.107   3.564  -0.078  1.00  0.00           H  
HETATM   31  H   UNL     1       6.162   2.316   1.838  1.00  0.00           H  
HETATM   32  H   UNL     1       5.493   0.690   1.557  1.00  0.00           H  
HETATM   33  H   UNL     1       7.254   0.948   1.516  1.00  0.00           H  
HETATM   34  H   UNL     1       4.886   2.473  -1.577  1.00  0.00           H  
HETATM   35  H   UNL     1       4.635   3.033   0.093  1.00  0.00           H  
HETATM   36  H   UNL     1       3.451   1.652   1.702  1.00  0.00           H  
HETATM   37  H   UNL     1       1.773  -0.118   2.043  1.00  0.00           H  
HETATM   38  H   UNL     1       2.372  -1.457  -1.962  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.104  -0.874  -2.215  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.874   0.500   1.543  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.799   0.224  -1.370  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.952   1.255  -1.605  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.801   2.385  -0.852  1.00  0.00           H  
CONECT    1    9   13   13   25                                       
CONECT    2   18   14   14   26                                       
CONECT    3   14    5    5   15                                       
CONECT    4   16   19   22   22                                       
CONECT    5   18    3    3   27                                       
CONECT    6   17   28   29   30                                       
CONECT    7   17   31   32   33                                       
CONECT    8   17    9   34   35                                       
CONECT    9    8   10   10    1                                       
CONECT   10    9    9   11   36                                       
CONECT   11   10   12   12   37                                       
CONECT   12   11   11   13   24                                       
CONECT   13    1    1   12   38                                       
CONECT   14    2    2    3   39                                       
CONECT   15    3   16   16   40                                       
CONECT   16   15   15    4   41                                       
CONECT   17    7    6    8                                            
CONECT   18   24    2    5                                            
CONECT   19    4   23   42                                            
CONECT   20   24   24                                                 
CONECT   21   24   24                                                 
CONECT   22    4    4                                                 
CONECT   23   19   43                                                 
CONECT   24   12   21   21   20                                       
CONECT   24   20   18                                                 
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   19                                                      
CONECT   43   23                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
