COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.302  -1.409  -1.368  1.00  0.00           C  
HETATM    2  C   UNL     1       4.608  -1.203  -0.047  1.00  0.00           C  
HETATM    3  C   UNL     1       2.988  -0.021   1.357  1.00  0.00           C  
HETATM    4  C   UNL     1       1.477  -0.265   1.258  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.777   0.619  -0.015  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.412   0.082   1.091  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.592  -0.616   0.942  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.147  -0.780  -0.331  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.499  -0.233  -1.444  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.320   0.462  -1.278  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.406  -1.523  -0.500  1.00  0.00           C  
HETATM   12  C   UNL     1       1.577   0.130  -1.239  1.00  0.00           C  
HETATM   13  C   UNL     1       3.088   0.375  -1.140  1.00  0.00           C  
HETATM   14  N   UNL     1       3.598  -0.316   0.053  1.00  0.00           N  
HETATM   15  N   UNL     1       0.967   0.425   0.065  1.00  0.00           N  
HETATM   16  O   UNL     1      -0.164   2.375  -0.938  1.00  0.00           O  
HETATM   17  O   UNL     1      -0.263   1.985   1.528  1.00  0.00           O  
HETATM   18  O   UNL     1       4.957  -1.836   0.927  1.00  0.00           O  
HETATM   19  S   UNL     1      -0.273   1.515   0.187  1.00  0.00           S  
HETATM   20  H   UNL     1       4.742  -2.130  -1.964  1.00  0.00           H  
HETATM   21  H   UNL     1       5.356  -0.460  -1.902  1.00  0.00           H  
HETATM   22  H   UNL     1       6.310  -1.786  -1.194  1.00  0.00           H  
HETATM   23  H   UNL     1       3.173   1.020   1.621  1.00  0.00           H  
HETATM   24  H   UNL     1       3.414  -0.673   2.119  1.00  0.00           H  
HETATM   25  H   UNL     1       1.284  -1.335   1.172  1.00  0.00           H  
HETATM   26  H   UNL     1       0.984   0.125   2.148  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.982   0.209   2.074  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.086  -1.035   1.806  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.922  -0.355  -2.430  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.819   0.885  -2.136  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.832  -1.648  -1.484  1.00  0.00           H  
HETATM   32  H   UNL     1       1.150   0.784  -2.000  1.00  0.00           H  
HETATM   33  H   UNL     1       1.389  -0.910  -1.505  1.00  0.00           H  
HETATM   34  H   UNL     1       3.582  -0.018  -2.029  1.00  0.00           H  
HETATM   35  H   UNL     1       3.281   1.444  -1.054  1.00  0.00           H  
HETATM   36  O   UNL     1      -5.964  -1.996   0.467  1.00  0.00           O  
CONECT    1    2   20   21   22                                       
CONECT    2   14    1   18   18                                       
CONECT    3   14    4   23   24                                       
CONECT    4    3   15   25   26                                       
CONECT    5   19    6    6   10                                       
CONECT    6    5    5    7   27                                       
CONECT    7    6    8    8   28                                       
CONECT    8    7    7    9   11                                       
CONECT    9   10   10    8   29                                       
CONECT   10    5    9    9   30                                       
CONECT   11    8   31   36   36                                       
CONECT   12   13   15   32   33                                       
CONECT   13   14   12   34   35                                       
CONECT   14   13    3    2                                            
CONECT   15   12    4   19                                            
CONECT   16   19   19                                                 
CONECT   17   19   19                                                 
CONECT   18    2    2                                                 
CONECT   19   15   17   17   16                                       
CONECT   19   16    5                                                 
CONECT   20    1                                                      
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    3                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   13                                                      
CONECT   36   11   11                                                 
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
