COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.263   0.796   1.835  1.00  0.00           C  
HETATM    2  C   UNL     1       3.195  -0.384   0.901  1.00  0.00           C  
HETATM    3  C   UNL     1       4.107  -1.413   1.019  1.00  0.00           C  
HETATM    4  C   UNL     1       3.072  -2.557  -0.817  1.00  0.00           C  
HETATM    5  C   UNL     1       2.151  -1.536  -0.941  1.00  0.00           C  
HETATM    6  C   UNL     1       2.208  -0.442  -0.081  1.00  0.00           C  
HETATM    7  C   UNL     1       1.220   0.658  -0.210  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.034   1.479   0.000  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.614   2.731  -0.457  1.00  0.00           C  
HETATM   10  C   UNL     1       0.709   2.937  -0.791  1.00  0.00           C  
HETATM   11  C   UNL     1       1.626   1.910  -0.670  1.00  0.00           C  
HETATM   12  C   UNL     1       3.069   2.145  -1.038  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.452   1.258   0.357  1.00  0.00           C  
HETATM   14  N   UNL     1      -4.250  -0.421   0.586  1.00  0.00           N  
HETATM   15  C   UNL     1      -4.591  -1.660   0.351  1.00  0.00           C  
HETATM   16  C   UNL     1       4.046  -2.498   0.162  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.112   0.440   0.124  1.00  0.00           C  
HETATM   18  O   UNL     1      -3.123   2.179   0.781  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.050  -0.076   0.199  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.662  -2.416  -0.259  1.00  0.00           C  
HETATM   21  S   UNL     1      -2.267  -1.467  -0.544  1.00  0.00           S  
HETATM   22  H   UNL     1       3.985   1.518   1.456  1.00  0.00           H  
HETATM   23  H   UNL     1       2.280   1.264   1.900  1.00  0.00           H  
HETATM   24  H   UNL     1       3.570   0.459   2.825  1.00  0.00           H  
HETATM   25  H   UNL     1       4.871  -1.371   1.782  1.00  0.00           H  
HETATM   26  H   UNL     1       3.029  -3.406  -1.483  1.00  0.00           H  
HETATM   27  H   UNL     1       1.391  -1.584  -1.707  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.326   3.538  -0.550  1.00  0.00           H  
HETATM   29  H   UNL     1       1.030   3.906  -1.145  1.00  0.00           H  
HETATM   30  H   UNL     1       3.197   2.010  -2.112  1.00  0.00           H  
HETATM   31  H   UNL     1       3.353   3.160  -0.762  1.00  0.00           H  
HETATM   32  H   UNL     1       3.700   1.433  -0.504  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.558  -2.052   0.629  1.00  0.00           H  
HETATM   34  H   UNL     1       4.762  -3.300   0.259  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.431  -0.529   0.476  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.778  -3.456  -0.527  1.00  0.00           H  
CONECT    1    2   22   23   24                                       
CONECT    2    1    3    3    6                                       
CONECT    3    2    2   16   25                                       
CONECT    4    5   16   16   26                                       
CONECT    5    4    6    6   27                                       
CONECT    6    2    5    5    7                                       
CONECT    7    6   11   11   17                                       
CONECT    8    9   13   17   17                                       
CONECT    9    8   10   10   28                                       
CONECT   10    9    9   11   29                                       
CONECT   11    7    7   10   12                                       
CONECT   12   11   30   31   32                                       
CONECT   13    8   18   18   19                                       
CONECT   14   15   19   19                                            
CONECT   15   14   20   20   33                                       
CONECT   16    3    4    4   34                                       
CONECT   17    7    8    8   35                                       
CONECT   18   13   13                                                 
CONECT   19   13   14   14   21                                       
CONECT   20   15   15   21   36                                       
CONECT   21   19   20                                                 
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   12                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   15                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   20                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
