COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      -2.733   1.373   0.521  1.00  0.00           C  
HETATM    2  C   UNK A   0      -3.803   2.191   0.697  1.00  0.00           C  
HETATM    3  C   UNK A   1       4.250  -1.198   0.495  1.00  0.00           C  
HETATM    4  C   UNK A   0       3.655   0.925  -0.490  1.00  0.00           C  
HETATM    5  C   UNK A   0       0.098  -2.056   0.382  1.00  0.00           C  
HETATM    6  C   UNK A   0      -2.921   0.090  -0.021  1.00  0.00           C  
HETATM    7  C   UNK A   0       3.270  -0.329   0.006  1.00  0.00           C  
HETATM    8  C   UNK A   0      -5.348   0.556  -0.169  1.00  0.00           C  
HETATM    9  C   UNK A   0      -4.278  -0.339  -0.382  1.00  0.00           C  
HETATM   10  C   UNK A   0      -5.099   1.790   0.351  1.00  0.00           C  
HETATM   11  C   UNK A   1       5.575  -0.779   0.469  1.00  0.00           C  
HETATM   12  C   UNK A   0      -2.073  -0.979  -0.335  1.00  0.00           C  
HETATM   13  C   UNK A   0      -0.619  -1.018  -0.149  1.00  0.00           C  
HETATM   14  C   UNK A   1       5.878   0.490  -0.043  1.00  0.00           C  
HETATM   15  C   UNK A   0       1.849  -0.726   0.012  1.00  0.00           C  
HETATM   16  C   UNK A   1       7.280   0.946  -0.077  1.00  0.00           C  
HETATM   17  C   UNK A   0      -8.846  -0.925   0.317  1.00  0.00           C  
HETATM   18  C   UNK A   0      -6.756   0.154  -0.526  1.00  0.00           C  
HETATM   19  C   UNK A   0      -7.416  -0.517   0.680  1.00  0.00           C  
HETATM   20  N   UNK A   1       4.915   1.287  -0.500  1.00  0.00           N  
HETATM   21  N   UNK A   0       1.388  -1.865   0.450  1.00  0.00           N  
HETATM   22  N   UNK A   0      -2.842  -1.970  -0.841  1.00  0.00           N  
HETATM   23  N   UNK A   0      -4.181  -1.567  -0.863  1.00  0.00           N  
HETATM   24  O   UNK A   1       8.164   0.224   0.338  1.00  0.00           O  
HETATM   25  O   UNK A   0      -6.134   2.648   0.549  1.00  0.00           O  
HETATM   26  O   UNK A   1       6.561  -1.587   0.933  1.00  0.00           O  
HETATM   27  O   UNK A   1       7.580   2.165  -0.568  1.00  0.00           O  
HETATM   28  S   UNK A   0       0.515   0.264  -0.571  1.00  0.00           S  
HETATM   29  H   UNK A   0      -1.743   1.708   0.793  1.00  0.00           H  
HETATM   30  H   UNK A   0      -3.651   3.176   1.115  1.00  0.00           H  
HETATM   31  H   UNK A   1       3.984  -2.168   0.888  1.00  0.00           H  
HETATM   32  H   UNK A   0       2.904   1.602  -0.870  1.00  0.00           H  
HETATM   33  H   UNK A   0      -0.370  -2.967   0.726  1.00  0.00           H  
HETATM   34  H   UNK A   0      -8.823  -1.623  -0.520  1.00  0.00           H  
HETATM   35  H   UNK A   0      -9.316  -1.403   1.177  1.00  0.00           H  
HETATM   36  H   UNK A   0      -9.416  -0.040   0.037  1.00  0.00           H  
HETATM   37  H   UNK A   0      -7.327   1.039  -0.807  1.00  0.00           H  
HETATM   38  H   UNK A   0      -6.734  -0.544  -1.363  1.00  0.00           H  
HETATM   39  H   UNK A   0      -7.439   0.181   1.517  1.00  0.00           H  
HETATM   40  H   UNK A   0      -6.846  -1.403   0.960  1.00  0.00           H  
HETATM   41  H   UNK A   0      -2.514  -2.831  -1.142  1.00  0.00           H  
HETATM   42  H   UNK A   0      -6.318   3.223  -0.206  1.00  0.00           H  
HETATM   43  H   UNK A   1       6.941  -2.170   0.261  1.00  0.00           H  
HETATM   44  H   UNK A   1       8.512   2.420  -0.570  1.00  0.00           H  
CONECT    1    2    2    6   29                                       
CONECT    2   10    1    1   30                                       
CONECT    3    7    7   11   31                                       
CONECT    4    7   20   20   32                                       
CONECT    5   21   13   13   33                                       
CONECT    6    1    9   12   12                                       
CONECT    7   15    3    3    4                                       
CONECT    8   10   10   18    9                                       
CONECT    9    8    6   23   23                                       
CONECT   10   25    2    8    8                                       
CONECT   11    3   26   14   14                                       
CONECT   12    6    6   13   22                                       
CONECT   13    5    5   12   28                                       
CONECT   14   11   11   20   16                                       
CONECT   15   21   21    7   28                                       
CONECT   16   14   24   24   27                                       
CONECT   17   19   34   35   36                                       
CONECT   18    8   19   37   38                                       
CONECT   19   18   17   39   40                                       
CONECT   20    4    4   14                                            
CONECT   21    5   15   15                                            
CONECT   22   12   23   41                                            
CONECT   23    9    9   22                                            
CONECT   24   16   16                                                 
CONECT   25   10   42                                                 
CONECT   26   11   43                                                 
CONECT   27   16   44                                                 
CONECT   28   13   15                                                 
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   22                                                      
CONECT   42   25                                                      
CONECT   43   26                                                      
CONECT   44   27                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
