COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.295   2.490  -0.086  1.00  0.00           C  
HETATM    2  C   UNL     1       1.913   2.519  -0.171  1.00  0.00           C  
HETATM    3  C   UNL     1       1.194   1.326  -0.179  1.00  0.00           C  
HETATM    4  C   UNL     1       1.866   0.115  -0.101  1.00  0.00           C  
HETATM    5  C   UNL     1       3.246   0.095  -0.016  1.00  0.00           C  
HETATM    6  C   UNL     1       3.958   1.280  -0.008  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.926   0.315   0.212  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.045  -0.840   0.548  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.500  -0.636   0.212  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.030  -1.122  -0.973  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.368  -0.916  -1.248  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.670   0.207   0.741  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.341   0.039   1.083  1.00  0.00           C  
HETATM   14  N   UNL     1       4.432  -1.921  -1.467  1.00  0.00           N  
HETATM   15  N   UNL     1      -0.205   1.348  -0.265  1.00  0.00           N  
HETATM   16  N   UNL     1      -2.261   0.283   0.029  1.00  0.00           N  
HETATM   17  N   UNL     1      -7.138  -0.265  -0.398  1.00  0.00           N  
HETATM   18  O   UNL     1       5.350  -1.170   0.698  1.00  0.00           O  
HETATM   19  O   UNL     1       3.168  -2.385   0.601  1.00  0.00           O  
HETATM   20  O   UNL     1       1.259   3.709  -0.247  1.00  0.00           O  
HETATM   21  O   UNL     1      -0.373  -0.589   0.809  1.00  0.00           O  
HETATM   22  S   UNL     1       4.098  -1.444   0.084  1.00  0.00           S  
HETATM   23  H   UNL     1       3.855   3.414  -0.084  1.00  0.00           H  
HETATM   24  H   UNL     1       1.312  -0.812  -0.107  1.00  0.00           H  
HETATM   25  H   UNL     1       5.036   1.260   0.054  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.927  -0.897   1.630  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.695  -1.768   0.096  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.404  -1.656  -1.674  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.789  -1.291  -2.169  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.331   0.735   1.412  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.964   0.428   2.017  1.00  0.00           H  
HETATM   32  H   UNL     1       5.219  -2.456  -1.650  1.00  0.00           H  
HETATM   33  H   UNL     1       3.840  -1.664  -2.191  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.654   2.108  -0.669  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.703   1.004  -0.447  1.00  0.00           H  
HETATM   36  H   UNL     1       1.016   4.079   0.612  1.00  0.00           H  
CONECT    1    2    6    6   23                                       
CONECT    2   20    3    3    1                                       
CONECT    3   15    2    2    4                                       
CONECT    4    3    5    5   24                                       
CONECT    5    4    4    6   22                                       
CONECT    6    1    1    5   25                                       
CONECT    7   21   21   16   15                                       
CONECT    8    9   16   26   27                                       
CONECT    9    8   10   10   13                                       
CONECT   10    9    9   11   28                                       
CONECT   11   10   17   17   29                                       
CONECT   12   13   13   17   30                                       
CONECT   13    9   12   12   31                                       
CONECT   14   22   32   33                                            
CONECT   15    7    3   34                                            
CONECT   16    8    7   35                                            
CONECT   17   11   11   12                                            
CONECT   18   22   22                                                 
CONECT   19   22   22                                                 
CONECT   20    2   36                                                 
CONECT   21    7    7                                                 
CONECT   22    5   14   19   19                                       
CONECT   22   18   18                                                 
CONECT   23    1                                                      
CONECT   24    4                                                      
CONECT   25    6                                                      
CONECT   26    8                                                      
CONECT   27    8                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   20                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
