COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK     1       1.487   0.988   2.713  1.00  0.00           N  
HETATM    2  C   UNK     1       0.077   0.585   2.796  1.00  0.00           C  
HETATM    3  C   UNK     1      -0.242  -0.389   1.661  1.00  0.00           C  
HETATM    4  S   UNK     1       0.063   0.418   0.066  1.00  0.00           S  
HETATM    5  C   UNK     1      -0.385  -0.930  -1.061  1.00  0.00           C  
HETATM    6  C   UNK     1      -0.205  -0.474  -2.486  1.00  0.00           C  
HETATM    7  C   UNK     1       1.008  -0.658  -3.121  1.00  0.00           C  
HETATM    8  C   UNK     1      -1.254   0.120  -3.160  1.00  0.00           C  
HETATM    9  C   UNK     1       1.174  -0.240  -4.428  1.00  0.00           C  
HETATM   10  C   UNK     1      -1.087   0.542  -4.465  1.00  0.00           C  
HETATM   11  C   UNK     1       0.126   0.360  -5.101  1.00  0.00           C  
HETATM   12  C   UNK     1      -0.176  -0.085   4.121  1.00  0.00           C  
HETATM   13  O   UNK     1       0.709  -0.696   4.668  1.00  0.00           O  
HETATM   14  O   UNK     1      -1.388  -0.003   4.693  1.00  0.00           O  
HETATM   15  H   UNK     1       1.635   1.335   1.777  1.00  0.00           H  
HETATM   16  H   UNK     1       2.035   0.145   2.799  1.00  0.00           H  
HETATM   17  H   UNK     1      -0.558   1.467   2.707  1.00  0.00           H  
HETATM   18  H   UNK     1       0.392  -1.270   1.749  1.00  0.00           H  
HETATM   19  H   UNK     1      -1.289  -0.688   1.722  1.00  0.00           H  
HETATM   20  H   UNK     1       0.254  -1.791  -0.870  1.00  0.00           H  
HETATM   21  H   UNK     1      -1.427  -1.208  -0.897  1.00  0.00           H  
HETATM   22  H   UNK     1       1.827  -1.127  -2.596  1.00  0.00           H  
HETATM   23  H   UNK     1      -2.203   0.263  -2.663  1.00  0.00           H  
HETATM   24  H   UNK     1       2.123  -0.382  -4.925  1.00  0.00           H  
HETATM   25  H   UNK     1      -1.906   1.011  -4.990  1.00  0.00           H  
HETATM   26  H   UNK     1       0.256   0.686  -6.122  1.00  0.00           H  
HETATM   27  H   UNK     1      -1.551  -0.434   5.544  1.00  0.00           H  
CONECT    1    2   15   16                                            
CONECT    2    1    3   12   17                                       
CONECT    3    2    4   18   19                                       
CONECT    4    3    5                                                 
CONECT    5    4    6   20   21                                       
CONECT    6    5    7    7    8                                       
CONECT    7    6    6    9   22                                       
CONECT    8    6   10   10   23                                       
CONECT    9    7   11   11   24                                       
CONECT   10    8    8   11   25                                       
CONECT   11    9    9   10   26                                       
CONECT   12    2   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   27                                                 
CONECT   15    1                                                      
CONECT   16    1                                                      
CONECT   17    2                                                      
CONECT   18    3                                                      
CONECT   19    3                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    7                                                      
CONECT   23    8                                                      
CONECT   24    9                                                      
CONECT   25   10                                                      
CONECT   26   11                                                      
CONECT   27   14                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
