COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.356   0.389  -1.323  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.089  -0.899   0.412  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.275   0.618   0.083  1.00  0.00           C  
HETATM    4  C   UNL     1       0.814   1.750   0.851  1.00  0.00           C  
HETATM    5  C   UNL     1       1.938   2.665   1.261  1.00  0.00           C  
HETATM    6  C   UNL     1       3.836  -1.748  -1.569  1.00  0.00           C  
HETATM    7  C   UNL     1       4.874  -0.849  -1.722  1.00  0.00           C  
HETATM    8  C   UNL     1       4.998   0.219  -0.852  1.00  0.00           C  
HETATM    9  C   UNL     1       4.082   0.387   0.170  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.301  -0.235   0.476  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.488  -1.431   1.674  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.488  -1.729   0.405  1.00  0.00           C  
HETATM   13  S   UNL     1      -0.739   2.276   0.211  1.00  0.00           S  
HETATM   14  C   UNL     1       0.845   0.420   0.917  1.00  0.00           C  
HETATM   15  O   UNL     1      -1.336  -2.264   1.434  1.00  0.00           O  
HETATM   16  N   UNL     1      -4.174  -1.237  -0.214  1.00  0.00           N  
HETATM   17  N   UNL     1      -4.345  -0.470  -1.237  1.00  0.00           N  
HETATM   18  N   UNL     1      -2.525   0.116  -0.307  1.00  0.00           N  
HETATM   19  C   UNL     1      -3.184   1.466  -2.363  1.00  0.00           C  
HETATM   20  C   UNL     1       2.045  -0.328   1.436  1.00  0.00           C  
HETATM   21  C   UNL     1       3.043  -0.512   0.322  1.00  0.00           C  
HETATM   22  C   UNL     1       2.917  -1.576  -0.551  1.00  0.00           C  
HETATM   23  H   UNL     1       2.637   2.776   0.433  1.00  0.00           H  
HETATM   24  H   UNL     1       1.533   3.642   1.527  1.00  0.00           H  
HETATM   25  H   UNL     1       2.457   2.241   2.120  1.00  0.00           H  
HETATM   26  H   UNL     1       3.739  -2.582  -2.248  1.00  0.00           H  
HETATM   27  H   UNL     1       5.590  -0.980  -2.520  1.00  0.00           H  
HETATM   28  H   UNL     1       5.809   0.921  -0.971  1.00  0.00           H  
HETATM   29  H   UNL     1       4.179   1.221   0.849  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.190  -0.592   2.304  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.240  -2.016   2.203  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.919  -1.980  -0.564  1.00  0.00           H  
HETATM   33  H   UNL     1       0.490  -2.205   0.480  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.662   2.383  -2.018  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.122   1.648  -2.526  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.645   1.145  -3.297  1.00  0.00           H  
HETATM   37  H   UNL     1       2.504   0.239   2.246  1.00  0.00           H  
HETATM   38  H   UNL     1       1.732  -1.304   1.808  1.00  0.00           H  
HETATM   39  H   UNL     1       2.102  -2.276  -0.434  1.00  0.00           H  
CONECT    1   19   17   17   18                                       
CONECT    2   18   16   16   11                                       
CONECT    3   13   18   10   10                                       
CONECT    4   13    5   14   14                                       
CONECT    5    4   23   24   25                                       
CONECT    6   22    7    7   26                                       
CONECT    7    6    6    8   27                                       
CONECT    8    9    9    7   28                                       
CONECT    9   21    8    8   29                                       
CONECT   10    3    3   14   12                                       
CONECT   11    2   15   30   31                                       
CONECT   12   10   15   32   33                                       
CONECT   13    4    3                                                 
CONECT   14    4    4   10   20                                       
CONECT   15   11   12                                                 
CONECT   16   17    2    2                                            
CONECT   17    1    1   16                                            
CONECT   18    1    3    2                                            
CONECT   19    1   34   35   36                                       
CONECT   20   14   21   37   38                                       
CONECT   21   20   22   22    9                                       
CONECT   22   21   21    6   39                                       
CONECT   23    5                                                      
CONECT   24    5                                                      
CONECT   25    5                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   19                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   20                                                      
CONECT   39   22                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
