COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.830   2.100   0.037  1.00  0.00           C  
HETATM    2  N   UNL     1      -1.157   3.178   0.927  1.00  0.00           N  
HETATM    3  O   UNL     1       1.086   3.170  -0.471  1.00  0.00           O  
HETATM    4  S   UNL     1       3.409   1.124  -0.747  1.00  0.00           S  
HETATM    5  C   UNL     1      -0.503   1.882   0.705  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.387   1.012  -0.192  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.575  -0.182  -0.359  1.00  0.00           C  
HETATM    8  N   UNL     1      -4.824  -0.493   0.340  1.00  0.00           N  
HETATM    9  C   UNL     1      -2.691   0.688   0.538  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.781  -1.267  -0.273  1.00  0.00           C  
HETATM   11  N   UNL     1       1.644  -0.165   0.501  1.00  0.00           N  
HETATM   12  C   UNL     1       1.819   1.011  -0.004  1.00  0.00           C  
HETATM   13  C   UNL     1       2.631  -1.052   0.388  1.00  0.00           C  
HETATM   14  C   UNL     1       2.680  -2.389   0.851  1.00  0.00           C  
HETATM   15  C   UNL     1       3.785  -3.152   0.640  1.00  0.00           C  
HETATM   16  C   UNL     1       4.888  -2.639  -0.033  1.00  0.00           C  
HETATM   17  C   UNL     1       4.873  -1.345  -0.496  1.00  0.00           C  
HETATM   18  C   UNL     1       3.750  -0.543  -0.291  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.576  -1.724  -1.476  1.00  0.00           N  
HETATM   20  N   UNL     1      -6.953  -1.559   0.384  1.00  0.00           N  
HETATM   21  H   UNL     1      -0.624   3.747   1.569  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.307   3.662   0.055  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.353   1.382   1.661  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.610   1.550  -1.113  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.863   0.086  -0.430  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.052  -1.108  -0.597  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.798   0.356  -1.280  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.976  -0.152   1.236  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.468   0.150   1.459  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.215   1.614   0.776  1.00  0.00           H  
HETATM   31  H   UNL     1       1.834  -2.805   1.377  1.00  0.00           H  
HETATM   32  H   UNL     1       3.806  -4.169   1.001  1.00  0.00           H  
HETATM   33  H   UNL     1       5.758  -3.259  -0.192  1.00  0.00           H  
HETATM   34  H   UNL     1       5.731  -0.948  -1.019  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.251  -2.270  -1.908  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.105  -1.218   1.279  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.628  -2.105  -0.049  1.00  0.00           H  
CONECT    1   12    3    3    5                                       
CONECT    2    5   21   22                                            
CONECT    3    1    1                                                 
CONECT    4   18   12                                                 
CONECT    5    1    2    6   23                                       
CONECT    6    5    9   24   25                                       
CONECT    7    9    8   26   27                                       
CONECT    8    7   10   28                                            
CONECT    9    6    7   29   30                                       
CONECT   10    8   19   19   20                                       
CONECT   11   13   12   12                                            
CONECT   12    1    4   11   11                                       
CONECT   13   11   18   14   14                                       
CONECT   14   13   13   15   31                                       
CONECT   15   14   16   16   32                                       
CONECT   16   15   15   17   33                                       
CONECT   17   16   18   18   34                                       
CONECT   18    4   13   17   17                                       
CONECT   19   10   10   35                                            
CONECT   20   10   36   37                                            
CONECT   21    2                                                      
CONECT   22    2                                                      
CONECT   23    5                                                      
CONECT   24    6                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31   14                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
CONECT   34   17                                                      
CONECT   35   19                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
