COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.861   1.479  -0.243  1.00  0.00           C  
HETATM    2  N   UNL     1       1.975  -0.818  -0.162  1.00  0.00           N  
HETATM    3  S   UNL     1       0.199   0.905   0.117  1.00  0.00           S  
HETATM    4  C   UNL     1      -5.048   0.182   0.216  1.00  0.00           C  
HETATM    5  N   UNL     1       0.866  -2.889  -0.499  1.00  0.00           N  
HETATM    6  C   UNL     1      -3.989  -0.711   0.221  1.00  0.00           C  
HETATM    7  N   UNL     1       2.900   1.338   0.190  1.00  0.00           N  
HETATM    8  O   UNL     1      -1.807  -2.451  -0.301  1.00  0.00           O  
HETATM    9  C   UNL     1      -2.558   1.003  -0.697  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.619   1.885  -0.697  1.00  0.00           C  
HETATM   11  O   UNL     1      -6.270  -0.211   0.661  1.00  0.00           O  
HETATM   12  C   UNL     1      -7.316   0.762   0.628  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.736  -0.303  -0.237  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.600  -1.251  -0.234  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.280  -0.768  -0.155  1.00  0.00           C  
HETATM   16  C   UNL     1       0.873  -1.521  -0.277  1.00  0.00           C  
HETATM   17  C   UNL     1       1.848   0.461   0.046  1.00  0.00           C  
HETATM   18  C   UNL     1       4.213   0.860   0.192  1.00  0.00           C  
HETATM   19  C   UNL     1       5.241   1.644  -0.316  1.00  0.00           C  
HETATM   20  C   UNL     1       6.537   1.168  -0.312  1.00  0.00           C  
HETATM   21  C   UNL     1       6.813  -0.088   0.196  1.00  0.00           C  
HETATM   22  C   UNL     1       5.792  -0.872   0.702  1.00  0.00           C  
HETATM   23  C   UNL     1       4.495  -0.399   0.707  1.00  0.00           C  
HETATM   24  H   UNL     1      -5.689   2.172  -0.250  1.00  0.00           H  
HETATM   25  H   UNL     1       1.704  -3.372  -0.578  1.00  0.00           H  
HETATM   26  H   UNL     1       0.024  -3.364  -0.577  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.133  -1.720   0.578  1.00  0.00           H  
HETATM   28  H   UNL     1       2.730   2.288   0.289  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.589   1.323  -1.052  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.480   2.894  -1.054  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.039   1.614   1.248  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.471   1.094  -0.398  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.236   0.319   1.010  1.00  0.00           H  
HETATM   34  H   UNL     1       5.027   2.625  -0.714  1.00  0.00           H  
HETATM   35  H   UNL     1       7.337   1.778  -0.707  1.00  0.00           H  
HETATM   36  H   UNL     1       7.828  -0.458   0.197  1.00  0.00           H  
HETATM   37  H   UNL     1       6.011  -1.852   1.098  1.00  0.00           H  
HETATM   38  H   UNL     1       3.698  -1.010   1.107  1.00  0.00           H  
CONECT    1    4    4   10   24                                       
CONECT    2   16   17   17                                            
CONECT    3   15   17                                                 
CONECT    4    1    1    6   11                                       
CONECT    5   16   25   26                                            
CONECT    6    4   13   13   27                                       
CONECT    7   17   18   28                                            
CONECT    8   14   14                                                 
CONECT    9   10   10   13   29                                       
CONECT   10    1    9    9   30                                       
CONECT   11    4   12                                                 
CONECT   12   11   31   32   33                                       
CONECT   13    6    6    9   14                                       
CONECT   14    8    8   13   15                                       
CONECT   15    3   14   16   16                                       
CONECT   16    2    5   15   15                                       
CONECT   17    2    2    3    7                                       
CONECT   18    7   19   19   23                                       
CONECT   19   18   18   20   34                                       
CONECT   20   19   21   21   35                                       
CONECT   21   20   20   22   36                                       
CONECT   22   21   23   23   37                                       
CONECT   23   18   22   22   38                                       
CONECT   24    1                                                      
CONECT   25    5                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   19                                                      
CONECT   35   20                                                      
CONECT   36   21                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
