COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.834  -1.327   0.000  1.00  0.00           C  
HETATM    2  C   UNL     1       0.425  -0.877  -0.021  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.604  -1.785   0.231  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.916  -1.359   0.210  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.213  -0.035  -0.061  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.197   0.870  -0.313  1.00  0.00           C  
HETATM    7  C   UNL     1       0.120   0.458  -0.288  1.00  0.00           C  
HETATM    8  C   UNL     1       4.221  -0.893  -0.223  1.00  0.00           C  
HETATM    9  C   UNL     1       5.139   0.292  -0.530  1.00  0.00           C  
HETATM   10  C   UNL     1       5.857   2.412   0.327  1.00  0.00           C  
HETATM   11  N   UNL     1      -4.275   0.985   1.449  1.00  0.00           N  
HETATM   12  N   UNL     1       2.825  -0.447  -0.244  1.00  0.00           N  
HETATM   13  O   UNL     1       2.097  -2.488   0.243  1.00  0.00           O  
HETATM   14  O   UNL     1      -3.927   1.668  -0.897  1.00  0.00           O  
HETATM   15  O   UNL     1      -4.676  -0.654  -0.352  1.00  0.00           O  
HETATM   16  O   UNL     1       5.035   1.259   0.517  1.00  0.00           O  
HETATM   17  S   UNL     1      -3.891   0.501  -0.087  1.00  0.00           S  
HETATM   18  H   UNL     1      -0.374  -2.819   0.443  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.714  -2.061   0.405  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.435   1.902  -0.525  1.00  0.00           H  
HETATM   21  H   UNL     1       0.912   1.167  -0.480  1.00  0.00           H  
HETATM   22  H   UNL     1       4.366  -1.669  -0.975  1.00  0.00           H  
HETATM   23  H   UNL     1       4.460  -1.292   0.762  1.00  0.00           H  
HETATM   24  H   UNL     1       6.169  -0.056  -0.602  1.00  0.00           H  
HETATM   25  H   UNL     1       4.842   0.747  -1.475  1.00  0.00           H  
HETATM   26  H   UNL     1       6.903   2.108   0.273  1.00  0.00           H  
HETATM   27  H   UNL     1       5.575   2.911  -0.600  1.00  0.00           H  
HETATM   28  H   UNL     1       5.721   3.097   1.164  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.610   0.935   2.154  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.165   1.318   1.645  1.00  0.00           H  
HETATM   31  H   UNL     1       2.615   0.480  -0.434  1.00  0.00           H  
CONECT    1   12   13   13    2                                       
CONECT    2    1    3    3    7                                       
CONECT    3    2    2    4   18                                       
CONECT    4    3    5    5   19                                       
CONECT    5    4    4    6   17                                       
CONECT    6    7    7    5   20                                       
CONECT    7    2    6    6   21                                       
CONECT    8    9   12   22   23                                       
CONECT    9    8   16   24   25                                       
CONECT   10   16   26   27   28                                       
CONECT   11   17   29   30                                            
CONECT   12    8    1   31                                            
CONECT   13    1    1                                                 
CONECT   14   17   17                                                 
CONECT   15   17   17                                                 
CONECT   16    9   10                                                 
CONECT   17    5   11   15   15                                       
CONECT   17   14   14                                                 
CONECT   18    3                                                      
CONECT   19    4                                                      
CONECT   20    6                                                      
CONECT   21    7                                                      
CONECT   22    8                                                      
CONECT   23    8                                                      
CONECT   24    9                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   10                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
