COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -3.855  -0.015   0.067  1.00  0.00           S  
HETATM    2  N   UNL     1      -4.198   1.113  -1.095  1.00  0.00           N  
HETATM    3  O   UNL     1      -4.192   0.578   1.314  1.00  0.00           O  
HETATM    4  O   UNL     1      -4.413  -1.240  -0.386  1.00  0.00           O  
HETATM    5  C   UNL     1      -2.107  -0.237   0.078  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.529  -1.194  -0.738  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.160  -1.368  -0.738  1.00  0.00           C  
HETATM    8  C   UNL     1       0.640  -0.580   0.086  1.00  0.00           C  
HETATM    9  C   UNL     1       0.053   0.382   0.906  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.317   0.548   0.898  1.00  0.00           C  
HETATM   11  C   UNL     1       2.113  -0.763   0.091  1.00  0.00           C  
HETATM   12  C   UNL     1       2.658  -2.037   0.240  1.00  0.00           C  
HETATM   13  C   UNL     1       4.028  -2.202   0.244  1.00  0.00           C  
HETATM   14  C   UNL     1       4.860  -1.106   0.100  1.00  0.00           C  
HETATM   15  C   UNL     1       4.324   0.161  -0.048  1.00  0.00           C  
HETATM   16  C   UNL     1       2.955   0.337  -0.060  1.00  0.00           C  
HETATM   17  C   UNL     1       2.372   1.717  -0.222  1.00  0.00           C  
HETATM   18  C   UNL     1       2.849   2.609   0.926  1.00  0.00           C  
HETATM   19  C   UNL     1       2.832   2.312  -1.554  1.00  0.00           C  
HETATM   20  H   UNL     1      -4.225   2.055  -0.864  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.373   0.833  -2.007  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.151  -1.804  -1.376  1.00  0.00           H  
HETATM   23  H   UNL     1       0.290  -2.115  -1.375  1.00  0.00           H  
HETATM   24  H   UNL     1       0.668   0.996   1.546  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.773   1.296   1.530  1.00  0.00           H  
HETATM   26  H   UNL     1       2.009  -2.893   0.353  1.00  0.00           H  
HETATM   27  H   UNL     1       4.452  -3.188   0.360  1.00  0.00           H  
HETATM   28  H   UNL     1       5.931  -1.240   0.104  1.00  0.00           H  
HETATM   29  H   UNL     1       4.978   1.013  -0.160  1.00  0.00           H  
HETATM   30  H   UNL     1       1.284   1.656  -0.207  1.00  0.00           H  
HETATM   31  H   UNL     1       3.937   2.670   0.911  1.00  0.00           H  
HETATM   32  H   UNL     1       2.428   3.608   0.809  1.00  0.00           H  
HETATM   33  H   UNL     1       2.522   2.186   1.876  1.00  0.00           H  
HETATM   34  H   UNL     1       2.493   1.676  -2.372  1.00  0.00           H  
HETATM   35  H   UNL     1       2.411   3.310  -1.671  1.00  0.00           H  
HETATM   36  H   UNL     1       3.920   2.372  -1.569  1.00  0.00           H  
CONECT    1    5    2    3    3                                       
CONECT    1    4    4                                                 
CONECT    2    1   20   21                                            
CONECT    3    1    1                                                 
CONECT    4    1    1                                                 
CONECT    5    6    6   10    1                                       
CONECT    6    7    5    5   22                                       
CONECT    7    8    8    6   23                                       
CONECT    8   11    7    7    9                                       
CONECT    9    8   10   10   24                                       
CONECT   10    9    9    5   25                                       
CONECT   11   12   12   16    8                                       
CONECT   12   13   11   11   26                                       
CONECT   13   14   14   12   27                                       
CONECT   14   13   13   15   28                                       
CONECT   15   14   16   16   29                                       
CONECT   16   15   15   11   17                                       
CONECT   17   18   16   19   30                                       
CONECT   18   17   31   32   33                                       
CONECT   19   17   34   35   36                                       
CONECT   20    2                                                      
CONECT   21    2                                                      
CONECT   22    6                                                      
CONECT   23    7                                                      
CONECT   24    9                                                      
CONECT   25   10                                                      
CONECT   26   12                                                      
CONECT   27   13                                                      
CONECT   28   14                                                      
CONECT   29   15                                                      
CONECT   30   17                                                      
CONECT   31   18                                                      
CONECT   32   18                                                      
CONECT   33   18                                                      
CONECT   34   19                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
