COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.155   2.236   1.646  1.00  0.00           C  
HETATM    2  C   UNL     1       6.005   1.660   0.860  1.00  0.00           C  
HETATM    3  C   UNL     1       6.079   1.587  -0.519  1.00  0.00           C  
HETATM    4  C   UNL     1       5.026   1.060  -1.241  1.00  0.00           C  
HETATM    5  C   UNL     1       3.894   0.603  -0.582  1.00  0.00           C  
HETATM    6  O   UNL     1       2.857   0.084  -1.291  1.00  0.00           O  
HETATM    7  C   UNL     1       1.724  -0.367  -0.546  1.00  0.00           C  
HETATM    8  C   UNL     1       0.667  -0.915  -1.507  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.495  -1.377  -0.744  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.587  -0.632  -0.399  1.00  0.00           C  
HETATM   11  S   UNL     1      -1.825   1.066  -0.808  1.00  0.00           S  
HETATM   12  C   UNL     1      -3.439   1.351  -0.041  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.864   2.802  -0.273  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.208   3.040   0.366  1.00  0.00           C  
HETATM   15  O   UNL     1      -5.768   2.141   0.948  1.00  0.00           O  
HETATM   16  O   UNL     1      -5.783   4.250   0.289  1.00  0.00           O  
HETATM   17  N   UNL     1      -2.431  -1.367   0.282  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.935  -2.625   0.415  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.412  -3.784   1.034  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.660  -4.937   0.998  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.433  -4.957   0.353  1.00  0.00           C  
HETATM   22  C   UNL     1       0.052  -3.821  -0.263  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.694  -2.653  -0.242  1.00  0.00           C  
HETATM   24  C   UNL     1       3.822   0.677   0.801  1.00  0.00           C  
HETATM   25  C   UNL     1       4.880   1.201   1.520  1.00  0.00           C  
HETATM   26  H   UNL     1       7.012   3.311   1.763  1.00  0.00           H  
HETATM   27  H   UNL     1       7.195   1.766   2.628  1.00  0.00           H  
HETATM   28  H   UNL     1       8.087   2.049   1.114  1.00  0.00           H  
HETATM   29  H   UNL     1       6.960   1.943  -1.031  1.00  0.00           H  
HETATM   30  H   UNL     1       4.826   1.254   2.597  1.00  0.00           H  
HETATM   31  H   UNL     1       5.084   1.004  -2.318  1.00  0.00           H  
HETATM   32  H   UNL     1       2.942   0.322   1.317  1.00  0.00           H  
HETATM   33  H   UNL     1       2.031  -1.154   0.143  1.00  0.00           H  
HETATM   34  H   UNL     1       1.305   0.466   0.018  1.00  0.00           H  
HETATM   35  H   UNL     1       0.359  -0.128  -2.196  1.00  0.00           H  
HETATM   36  H   UNL     1       1.086  -1.748  -2.071  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.175   0.681  -0.484  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.371   1.159   1.030  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.128   3.472   0.170  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.932   2.994  -1.344  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.646   4.354   0.715  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.366  -3.775   1.538  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.028  -5.832   1.477  1.00  0.00           H  
HETATM   44  H   UNL     1       0.148  -5.868   0.332  1.00  0.00           H  
HETATM   45  H   UNL     1       1.009  -3.843  -0.763  1.00  0.00           H  
CONECT    1    2   26   27   28                                       
CONECT    2    1    3   25   25                                       
CONECT    3    2    4    4   29                                       
CONECT    4    3    3    5   31                                       
CONECT    5    4    6   24   24                                       
CONECT    6    5    7                                                 
CONECT    7    6    8   33   34                                       
CONECT    8    7    9   35   36                                       
CONECT    9    8   10   23                                            
CONECT   10    9   11   17   17                                       
CONECT   11   10   12                                                 
CONECT   12   11   13   37   38                                       
CONECT   13   12   14   39   40                                       
CONECT   14   13   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   41                                                 
CONECT   17   10   10   18                                            
CONECT   18   17   19   19   23                                       
CONECT   19   18   18   20   42                                       
CONECT   20   19   21   21   43                                       
CONECT   21   20   20   22   44                                       
CONECT   22   21   23   23   45                                       
CONECT   23    9   18   22   22                                       
CONECT   24    5    5   25   32                                       
CONECT   25    2    2   24   30                                       
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    3                                                      
CONECT   30   25                                                      
CONECT   31    4                                                      
CONECT   32   24                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   16                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
