COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.381  -0.557  -0.711  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.005  -0.443  -0.733  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.381   0.554   0.007  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.144   1.439   0.757  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.520   1.323   0.770  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.138   0.326   0.037  1.00  0.00           C  
HETATM    7  N   UNL     1       1.015   0.669  -0.009  1.00  0.00           N  
HETATM    8  C   UNL     1       1.878  -0.392   0.018  1.00  0.00           C  
HETATM    9  C   UNL     1       3.170   0.152  -0.017  1.00  0.00           C  
HETATM   10  C   UNL     1       2.954   1.604  -0.057  1.00  0.00           C  
HETATM   11  N   UNL     1       1.649   1.784  -0.051  1.00  0.00           N  
HETATM   12  C   UNL     1       1.726  -1.792   0.065  1.00  0.00           C  
HETATM   13  C   UNL     1       4.293  -0.682   0.006  1.00  0.00           C  
HETATM   14  C   UNL     1       4.145  -2.034   0.051  1.00  0.00           C  
HETATM   15  C   UNL     1       2.869  -2.608   0.081  1.00  0.00           C  
HETATM   16  C   UNL     1       0.604  -2.651   0.102  1.00  0.00           C  
HETATM   17  N   UNL     1       2.424  -3.904   0.126  1.00  0.00           N  
HETATM   18  N   UNL     1       1.025  -3.883   0.138  1.00  0.00           N  
HETATM   19  C   UNL     1       3.990   2.651  -0.101  1.00  0.00           C  
HETATM   20  N   UNL     1       3.634   3.951  -0.140  1.00  0.00           N  
HETATM   21  O   UNL     1       5.166   2.343  -0.102  1.00  0.00           O  
HETATM   22  S   UNL     1      -4.894   0.181   0.057  1.00  0.00           S  
HETATM   23  O   UNL     1      -5.320   0.816   1.255  1.00  0.00           O  
HETATM   24  O   UNL     1      -5.174  -1.164  -0.306  1.00  0.00           O  
HETATM   25  N   UNL     1      -5.481   1.112  -1.180  1.00  0.00           N  
HETATM   26  H   UNL     1      -2.867  -1.335  -1.281  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.414  -1.133  -1.317  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.661   2.217   1.330  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.114   2.011   1.354  1.00  0.00           H  
HETATM   30  H   UNL     1       5.283  -0.250  -0.016  1.00  0.00           H  
HETATM   31  H   UNL     1       5.018  -2.669   0.064  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.429  -2.338   0.101  1.00  0.00           H  
HETATM   33  H   UNL     1       2.982  -4.697   0.146  1.00  0.00           H  
HETATM   34  H   UNL     1       4.316   4.640  -0.169  1.00  0.00           H  
HETATM   35  H   UNL     1       2.695   4.196  -0.144  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.870   1.605  -1.748  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.437   1.164  -1.336  1.00  0.00           H  
CONECT    1    2    2    6   26                                       
CONECT    2    1    1    3   27                                       
CONECT    3    2    4    4    7                                       
CONECT    4    3    3    5   28                                       
CONECT    5    4    6    6   29                                       
CONECT    6    1    5    5   22                                       
CONECT    7    3    8   11                                            
CONECT    8    7    9    9   12                                       
CONECT    9    8    8   10   13                                       
CONECT   10    9   11   11   19                                       
CONECT   11    7   10   10                                            
CONECT   12    8   15   15   16                                       
CONECT   13    9   14   14   30                                       
CONECT   14   13   13   15   31                                       
CONECT   15   12   12   14   17                                       
CONECT   16   12   18   18   32                                       
CONECT   17   15   18   33                                            
CONECT   18   16   16   17                                            
CONECT   19   10   20   21   21                                       
CONECT   20   19   34   35                                            
CONECT   21   19   19                                                 
CONECT   22    6   23   23   24                                       
CONECT   22   24   25                                                 
CONECT   23   22   22                                                 
CONECT   24   22   22                                                 
CONECT   25   22   36   37                                            
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30   13                                                      
CONECT   31   14                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
CONECT   34   20                                                      
CONECT   35   20                                                      
CONECT   36   25                                                      
CONECT   37   25                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
