COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.505   2.182   0.081  1.00  0.00           C  
HETATM    2  C   UNL     1       4.694   1.198   0.930  1.00  0.00           C  
HETATM    3  C   UNL     1       2.267  -0.180   0.345  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.415  -1.197  -0.118  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.401  -2.136   0.188  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.091  -0.431   0.118  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.707  -1.773   0.305  1.00  0.00           C  
HETATM    8  C   UNL     1       6.918   1.632  -0.121  1.00  0.00           C  
HETATM    9  C   UNL     1       6.846   0.298  -0.868  1.00  0.00           C  
HETATM   10  C   UNL     1       6.050  -0.709  -0.031  1.00  0.00           C  
HETATM   11  C   UNL     1       3.603  -0.791   0.008  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.092  -0.754   0.145  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.762   0.131  -0.307  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.087   0.509  -0.190  1.00  0.00           C  
HETATM   15  N   UNL     1       4.740  -0.125   0.292  1.00  0.00           N  
HETATM   16  N   UNL     1       1.196  -1.093  -0.060  1.00  0.00           N  
HETATM   17  N   UNL     1      -1.078  -1.594  -0.228  1.00  0.00           N  
HETATM   18  N   UNL     1      -6.284   0.173   0.176  1.00  0.00           N  
HETATM   19  N   UNL     1      -6.374   1.424  -0.036  1.00  0.00           N  
HETATM   20  O   UNL     1       3.655  -1.883  -0.518  1.00  0.00           O  
HETATM   21  O   UNL     1      -0.365   0.310   0.666  1.00  0.00           O  
HETATM   22  S   UNL     1      -4.964   2.033  -0.341  1.00  0.00           S  
HETATM   23  H   UNL     1       5.022   2.311  -0.887  1.00  0.00           H  
HETATM   24  H   UNL     1       5.559   3.144   0.592  1.00  0.00           H  
HETATM   25  H   UNL     1       5.123   1.137   1.929  1.00  0.00           H  
HETATM   26  H   UNL     1       3.660   1.538   0.996  1.00  0.00           H  
HETATM   27  H   UNL     1       2.209  -0.004   1.419  1.00  0.00           H  
HETATM   28  H   UNL     1       2.157   0.767  -0.184  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.122  -3.169   0.334  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.453  -2.517   0.542  1.00  0.00           H  
HETATM   31  H   UNL     1       7.505   2.342  -0.704  1.00  0.00           H  
HETATM   32  H   UNL     1       7.391   1.479   0.849  1.00  0.00           H  
HETATM   33  H   UNL     1       6.351   0.445  -1.828  1.00  0.00           H  
HETATM   34  H   UNL     1       7.854  -0.082  -1.033  1.00  0.00           H  
HETATM   35  H   UNL     1       5.911  -1.628  -0.600  1.00  0.00           H  
HETATM   36  H   UNL     1       6.590  -0.925   0.891  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.005   0.864  -0.544  1.00  0.00           H  
HETATM   38  H   UNL     1       1.414  -1.942  -0.475  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.860  -2.475  -0.572  1.00  0.00           H  
CONECT    1    2    8   23   24                                       
CONECT    2   15    1   25   26                                       
CONECT    3   16   11   27   28                                       
CONECT    4    5   17   13   13                                       
CONECT    5    7    7    4   29                                       
CONECT    6    7   18   14   14                                       
CONECT    7    5    5    6   30                                       
CONECT    8    9    1   31   32                                       
CONECT    9   10    8   33   34                                       
CONECT   10    9   15   35   36                                       
CONECT   11   20   20    3   15                                       
CONECT   12   17   16   21   21                                       
CONECT   13    4    4   14   37                                       
CONECT   14    6    6   13   22                                       
CONECT   15   11   10    2                                            
CONECT   16   12    3   38                                            
CONECT   17    4   12   39                                            
CONECT   18    6   19   19                                            
CONECT   19   18   18   22                                            
CONECT   20   11   11                                                 
CONECT   21   12   12                                                 
CONECT   22   14   19                                                 
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   13                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
