COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.475   0.713   0.477  1.00  0.00           C  
HETATM    2  C   UNL     1       3.966  -0.342  -0.032  1.00  0.00           C  
HETATM    3  C   UNL     1       3.543   1.833  -1.228  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.937   0.294   0.573  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.143   1.062   1.116  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.003   1.554  -0.050  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.718  -1.863  -0.780  1.00  0.00           C  
HETATM    8  C   UNL     1       4.344  -2.562   1.050  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.804   0.382  -0.621  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.882  -0.504  -1.463  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.492  -1.657   0.719  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.057  -1.182   0.958  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.707   0.849   1.143  1.00  0.00           N  
HETATM   14  S   UNL     1       2.002   1.306   1.009  1.00  0.00           S  
HETATM   15  N   UNL     1       0.639   0.105  -0.674  1.00  0.00           N  
HETATM   16  C   UNL     1       1.808   0.016  -1.253  1.00  0.00           C  
HETATM   17  O   UNL     1       1.994  -0.540  -2.317  1.00  0.00           O  
HETATM   18  C   UNL     1       2.907   0.681  -0.448  1.00  0.00           C  
HETATM   19  C   UNL     1       3.284  -1.539   0.635  1.00  0.00           C  
HETATM   20  H   UNL     1       4.511  -0.679  -0.914  1.00  0.00           H  
HETATM   21  H   UNL     1       4.660   0.118   0.670  1.00  0.00           H  
HETATM   22  H   UNL     1       4.025   1.442  -2.124  1.00  0.00           H  
HETATM   23  H   UNL     1       2.772   2.549  -1.513  1.00  0.00           H  
HETATM   24  H   UNL     1       4.286   2.329  -0.602  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.908   0.384  -0.513  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.736   0.406   1.753  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.797   1.917   1.698  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.688   2.324   0.302  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.359   1.967  -0.827  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.618  -2.458  -0.933  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.861  -2.383  -1.208  1.00  0.00           H  
HETATM   32  H   UNL     1       3.858  -3.415   1.525  1.00  0.00           H  
HETATM   33  H   UNL     1       4.889  -2.899   0.168  1.00  0.00           H  
HETATM   34  H   UNL     1       5.038  -2.102   1.752  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.223  -0.204   0.196  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.611   0.763  -1.246  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.908  -0.026  -1.559  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.318  -0.645  -2.452  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.189  -0.907   1.092  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.656  -2.598   1.244  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.373  -1.773   0.349  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.804  -1.305   2.011  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.734   1.312   1.995  1.00  0.00           H  
HETATM   44  H   UNL     1       2.739  -1.202   1.516  1.00  0.00           H  
HETATM   45  H   UNL     1       2.590  -2.000  -0.068  1.00  0.00           H  
CONECT    1   13   14   15   15                                       
CONECT    2   18   19   20   21                                       
CONECT    3   18   22   23   24                                       
CONECT    4    5   12   13   25                                       
CONECT    5    4    6   26   27                                       
CONECT    6    5    9   28   29                                       
CONECT    7   10   11   30   31                                       
CONECT    8   19   32   33   34                                       
CONECT    9    6   10   35   36                                       
CONECT   10    7    9   37   38                                       
CONECT   11    7   12   39   40                                       
CONECT   12    4   11   41   42                                       
CONECT   13    1    4   43                                            
CONECT   14    1   18                                                 
CONECT   15    1    1   16                                            
CONECT   16   15   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18    2    3   14   16                                       
CONECT   19    2    8   44   45                                       
CONECT   20    2                                                      
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    3                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
