COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.485  -1.334   0.084  1.00  0.00           C  
HETATM    2  C   UNL     1       1.530  -0.516  -0.403  1.00  0.00           C  
HETATM    3  C   UNL     1       0.778  -2.667   0.409  1.00  0.00           C  
HETATM    4  N   UNL     1       2.783  -1.065  -0.535  1.00  0.00           N  
HETATM    5  N   UNL     1       2.027  -3.118   0.248  1.00  0.00           N  
HETATM    6  C   UNL     1       2.986  -2.352  -0.202  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.618  -0.564   0.122  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.293   0.641  -0.314  1.00  0.00           C  
HETATM    9  N   UNL     1       1.002   0.678  -0.631  1.00  0.00           N  
HETATM   10  S   UNL     1      -1.405   2.001  -0.450  1.00  0.00           S  
HETATM   11  N   UNL     1      -0.206  -3.499   0.887  1.00  0.00           N  
HETATM   12  C   UNL     1       3.893  -0.252  -1.037  1.00  0.00           C  
HETATM   13  C   UNL     1       4.597   0.431   0.138  1.00  0.00           C  
HETATM   14  C   UNL     1       5.756   1.280  -0.386  1.00  0.00           C  
HETATM   15  C   UNL     1       6.433   1.937   0.744  1.00  0.00           C  
HETATM   16  C   UNL     1       6.973   2.461   1.646  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.959   1.285  -0.028  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.519   1.521   1.222  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.737   0.959   1.548  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.400   0.161   0.633  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.631   0.487  -0.947  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.846  -0.076  -0.611  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.030   0.233  -2.306  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.729  -0.451   0.994  1.00  0.00           C  
HETATM   25  H   UNL     1       3.977  -2.769  -0.312  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.110  -3.166   1.001  1.00  0.00           H  
HETATM   27  H   UNL     1       0.003  -4.420   1.109  1.00  0.00           H  
HETATM   28  H   UNL     1       4.602  -0.890  -1.564  1.00  0.00           H  
HETATM   29  H   UNL     1       3.509   0.506  -1.720  1.00  0.00           H  
HETATM   30  H   UNL     1       3.888   1.069   0.665  1.00  0.00           H  
HETATM   31  H   UNL     1       4.981  -0.327   0.821  1.00  0.00           H  
HETATM   32  H   UNL     1       6.466   0.642  -0.913  1.00  0.00           H  
HETATM   33  H   UNL     1       5.372   2.038  -1.069  1.00  0.00           H  
HETATM   34  H   UNL     1       7.456   2.929   2.452  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.002   2.144   1.937  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.173   1.143   2.519  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.368  -0.697  -1.325  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.404  -0.658  -2.265  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.828   0.083  -3.033  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.425   1.090  -2.602  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.532   0.228   0.708  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.848  -1.397   0.465  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.768  -0.628   2.068  1.00  0.00           H  
CONECT    1    3    3    2    7                                       
CONECT    2    1    4    9    9                                       
CONECT    3    1    1    5   11                                       
CONECT    4    2    6   12                                            
CONECT    5    3    6    6                                            
CONECT    6    4    5    5   25                                       
CONECT    7    1    8    8                                            
CONECT    8    7    7    9   10                                       
CONECT    9    8    2    2                                            
CONECT   10    8   17                                                 
CONECT   11    3   26   27                                            
CONECT   12    4   28   29   13                                       
CONECT   13   12   30   31   14                                       
CONECT   14   13   32   33   15                                       
CONECT   15   14   16   16   16                                       
CONECT   16   15   15   15   34                                       
CONECT   17   10   21   21   18                                       
CONECT   18   17   19   19   35                                       
CONECT   19   18   18   20   36                                       
CONECT   20   19   24   22   22                                       
CONECT   21   17   17   22   23                                       
CONECT   22   21   20   20   37                                       
CONECT   23   21   38   39   40                                       
CONECT   24   20   41   42   43                                       
CONECT   25    6                                                      
CONECT   26   11                                                      
CONECT   27   11                                                      
CONECT   28   12                                                      
CONECT   29   12                                                      
CONECT   30   13                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   14                                                      
CONECT   34   16                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
CONECT   41   24                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
