COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.215   3.657  -0.191  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.024  -1.112   0.534  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.215  -0.059  -1.618  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.372  -0.905   0.752  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.564   0.136  -1.399  1.00  0.00           C  
HETATM    6  C   UNL     1       3.967   2.569  -0.544  1.00  0.00           C  
HETATM    7  C   UNL     1       2.083   3.377   0.476  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.440  -0.690  -0.653  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.142  -0.282  -0.214  1.00  0.00           C  
HETATM   10  C   UNL     1       3.413   1.372  -0.142  1.00  0.00           C  
HETATM   11  C   UNL     1       3.965   0.103  -0.368  1.00  0.00           C  
HETATM   12  C   UNL     1       3.225  -1.040  -0.074  1.00  0.00           C  
HETATM   13  C   UNL     1       3.865  -2.300  -0.007  1.00  0.00           C  
HETATM   14  C   UNL     1       1.779  -0.938   0.166  1.00  0.00           C  
HETATM   15  C   UNL     1       3.048  -3.551   0.187  1.00  0.00           C  
HETATM   16  N   UNL     1      -5.019   1.459   0.796  1.00  0.00           N  
HETATM   17  N   UNL     1       0.924  -0.898  -0.876  1.00  0.00           N  
HETATM   18  O   UNL     1       5.074  -2.372  -0.105  1.00  0.00           O  
HETATM   19  O   UNL     1       1.353  -0.888   1.304  1.00  0.00           O  
HETATM   20  O   UNL     1      -5.464   0.099  -1.215  1.00  0.00           O  
HETATM   21  O   UNL     1      -5.263  -0.986   1.028  1.00  0.00           O  
HETATM   22  S   UNL     1       1.899   1.695   0.692  1.00  0.00           S  
HETATM   23  S   UNL     1      -4.861  -0.019   0.067  1.00  0.00           S  
HETATM   24  H   UNL     1       3.512   4.668  -0.428  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.424  -1.599   1.289  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.765   0.267  -2.544  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.826  -1.229   1.676  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.170   0.615  -2.155  1.00  0.00           H  
HETATM   29  H   UNL     1       4.900   2.641  -1.084  1.00  0.00           H  
HETATM   30  H   UNL     1       1.383   4.119   0.829  1.00  0.00           H  
HETATM   31  H   UNL     1       4.963   0.011  -0.769  1.00  0.00           H  
HETATM   32  H   UNL     1       1.988  -3.300   0.160  1.00  0.00           H  
HETATM   33  H   UNL     1       3.275  -4.260  -0.609  1.00  0.00           H  
HETATM   34  H   UNL     1       3.292  -3.998   1.151  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.232   1.994   0.984  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.899   1.791   1.035  1.00  0.00           H  
HETATM   37  H   UNL     1       1.256  -1.015  -1.780  1.00  0.00           H  
CONECT    1    6    7    7   24                                       
CONECT    2    8    4    4   25                                       
CONECT    3    8    8    5   26                                       
CONECT    4    2    2    9   27                                       
CONECT    5    3    9    9   28                                       
CONECT    6   10   10    1   29                                       
CONECT    7    1    1   22   30                                       
CONECT    8   17    3    3    2                                       
CONECT    9    5    5    4   23                                       
CONECT   10   11    6    6   22                                       
CONECT   11   12   12   10   31                                       
CONECT   12   13   11   11   14                                       
CONECT   13   15   18   18   12                                       
CONECT   14   12   19   19   17                                       
CONECT   15   13   32   33   34                                       
CONECT   16   23   35   36                                            
CONECT   17   14    8   37                                            
CONECT   18   13   13                                                 
CONECT   19   14   14                                                 
CONECT   20   23   23                                                 
CONECT   21   23   23                                                 
CONECT   22   10    7                                                 
CONECT   23    9   16   21   21                                       
CONECT   23   20   20                                                 
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31   11                                                      
CONECT   32   15                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
