COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.415  -0.263   0.288  1.00  0.00           C  
HETATM    2  C   UNL     1       5.859   0.253   0.345  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.720   2.886  -2.297  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.886   4.544  -0.575  1.00  0.00           C  
HETATM    5  C   UNL     1       0.136  -4.028  -0.788  1.00  0.00           C  
HETATM    6  N   UNL     1       2.073   0.277   0.521  1.00  0.00           N  
HETATM    7  C   UNL     1       0.948  -0.530   0.312  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.331  -0.016   0.534  1.00  0.00           C  
HETATM    9  O   UNL     1      -0.482   1.267   0.952  1.00  0.00           O  
HETATM   10  C   UNL     1       1.103  -1.834  -0.120  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.023  -2.636  -0.327  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.299  -2.116  -0.097  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.178   0.171   2.228  1.00  0.00           N  
HETATM   14  C   UNL     1       4.458   0.816   0.588  1.00  0.00           C  
HETATM   15  C   UNL     1       6.902   1.331   0.645  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.447  -0.814   0.328  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.605   2.236   0.008  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.590   1.900  -1.339  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.865   4.207  -1.916  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.762   3.561   0.388  1.00  0.00           C  
HETATM   21  O   UNL     1      -3.973  -1.216   0.348  1.00  0.00           O  
HETATM   22  O   UNL     1      -3.106   1.093  -0.060  1.00  0.00           O  
HETATM   23  O   UNL     1      -0.843  -4.724  -0.968  1.00  0.00           O  
HETATM   24  O   UNL     1       1.368  -4.528  -1.010  1.00  0.00           O  
HETATM   25  S   UNL     1      -3.059  -0.159   0.610  1.00  0.00           S  
HETATM   26  H   UNL     1       3.581  -1.120   0.941  1.00  0.00           H  
HETATM   27  H   UNL     1       3.505  -0.576  -0.752  1.00  0.00           H  
HETATM   28  H   UNL     1       6.025  -0.604   0.997  1.00  0.00           H  
HETATM   29  H   UNL     1       5.949  -0.060  -0.696  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.704   2.625  -3.345  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.999   5.577  -0.280  1.00  0.00           H  
HETATM   32  H   UNL     1       1.964   1.193   0.820  1.00  0.00           H  
HETATM   33  H   UNL     1       2.092  -2.232  -0.297  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.171  -2.734  -0.257  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.747   0.893   2.535  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.678  -0.359   2.869  1.00  0.00           H  
HETATM   37  H   UNL     1       4.292   1.673  -0.065  1.00  0.00           H  
HETATM   38  H   UNL     1       4.368   1.129   1.628  1.00  0.00           H  
HETATM   39  H   UNL     1       6.736   2.188  -0.008  1.00  0.00           H  
HETATM   40  H   UNL     1       6.812   1.644   1.685  1.00  0.00           H  
HETATM   41  H   UNL     1       7.900   0.930   0.471  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.477   0.868  -1.637  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.962   4.977  -2.667  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.786   3.824   1.435  1.00  0.00           H  
HETATM   45  H   UNL     1       1.422  -5.445  -1.312  1.00  0.00           H  
CONECT    1   14    6   26   27                                       
CONECT    2   15   14   28   29                                       
CONECT    3   18   18   19   30                                       
CONECT    4   20   19   19   31                                       
CONECT    5   23   23   11   24                                       
CONECT    6    1    7   32                                            
CONECT    7    6   10   10    8                                       
CONECT    8    7    9   16   16                                       
CONECT    9    8   17                                                 
CONECT   10    7    7   11   33                                       
CONECT   11   10    5   12   12                                       
CONECT   12   11   11   16   34                                       
CONECT   13   25   35   36                                            
CONECT   14    2    1   37   38                                       
CONECT   15    2   39   40   41                                       
CONECT   16    8    8   12   25                                       
CONECT   17    9   20   20   18                                       
CONECT   18   17    3    3   42                                       
CONECT   19    4    4    3   43                                       
CONECT   20   17   17    4   44                                       
CONECT   21   25   25                                                 
CONECT   22   25   25                                                 
CONECT   23    5    5                                                 
CONECT   24    5   45                                                 
CONECT   25   16   21   21   22                                       
CONECT   25   22   13                                                 
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33   10                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   24                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
