COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.093   2.955  -1.114  1.00  0.00           C  
HETATM    2  N   UNL     1       1.442   1.371   0.075  1.00  0.00           N  
HETATM    3  C   UNL     1       0.346   0.585  -0.548  1.00  0.00           C  
HETATM    4  C   UNL     1       4.935  -0.296   0.267  1.00  0.00           C  
HETATM    5  C   UNL     1       8.198  -2.162   0.308  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.111  -2.379   0.348  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.783  -1.783  -0.042  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.009  -0.254   0.347  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.857   0.979   0.046  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.701   1.641  -0.964  1.00  0.00           C  
HETATM   11  C   UNL     1       1.553   2.583  -0.776  1.00  0.00           C  
HETATM   12  C   UNL     1       2.631   0.652   0.075  1.00  0.00           C  
HETATM   13  C   UNL     1       6.749  -1.815   0.082  1.00  0.00           C  
HETATM   14  N   UNL     1      -6.237  -0.804   0.707  1.00  0.00           N  
HETATM   15  N   UNL     1      -4.304  -0.602  -0.682  1.00  0.00           N  
HETATM   16  N   UNL     1      -3.117   0.077  -0.849  1.00  0.00           N  
HETATM   17  N   UNL     1      -1.724   1.780   0.076  1.00  0.00           N  
HETATM   18  N   UNL     1       2.787  -0.544  -0.400  1.00  0.00           N  
HETATM   19  N   UNL     1       4.057  -1.066  -0.295  1.00  0.00           N  
HETATM   20  N   UNL     1       6.273  -0.617   0.476  1.00  0.00           N  
HETATM   21  O   UNL     1       6.011  -2.613  -0.456  1.00  0.00           O  
HETATM   22  O   UNL     1      -6.204  -2.185  -1.029  1.00  0.00           O  
HETATM   23  S   UNL     1       4.168   1.223   0.717  1.00  0.00           S  
HETATM   24  S   UNL     1      -4.174   1.030   1.214  1.00  0.00           S  
HETATM   25  H   UNL     1       0.024   3.324  -2.137  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.280   3.704  -0.416  1.00  0.00           H  
HETATM   27  H   UNL     1       0.713   0.048  -1.423  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.080  -0.112   0.174  1.00  0.00           H  
HETATM   29  H   UNL     1       8.395  -3.164  -0.074  1.00  0.00           H  
HETATM   30  H   UNL     1       8.830  -1.444  -0.213  1.00  0.00           H  
HETATM   31  H   UNL     1       8.416  -2.131   1.375  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.389  -3.150  -0.371  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.034  -2.819   1.342  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.871  -1.597   0.354  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.160   1.365  -1.913  1.00  0.00           H  
HETATM   36  H   UNL     1       2.108   2.359  -1.687  1.00  0.00           H  
HETATM   37  H   UNL     1       2.034   3.392  -0.226  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.700  -0.483   1.497  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.609   2.432   0.785  1.00  0.00           H  
HETATM   40  H   UNL     1       6.864   0.021   0.906  1.00  0.00           H  
CONECT    1   11   10   25   26                                       
CONECT    2   11   12    3                                            
CONECT    3   10    2   27   28                                       
CONECT    4   23   20   19   19                                       
CONECT    5   13   29   30   31                                       
CONECT    6    7   32   33   34                                       
CONECT    7    6   14   22   22                                       
CONECT    8   14   24   15   15                                       
CONECT    9   24   17   16   16                                       
CONECT   10   17    1    3   35                                       
CONECT   11    1    2   36   37                                       
CONECT   12   23    2   18   18                                       
CONECT   13   20    5   21   21                                       
CONECT   14    7    8   38                                            
CONECT   15    8    8   16                                            
CONECT   16    9    9   15                                            
CONECT   17    9   10   39                                            
CONECT   18   12   12   19                                            
CONECT   19    4    4   18                                            
CONECT   20    4   13   40                                            
CONECT   21   13   13                                                 
CONECT   22    7    7                                                 
CONECT   23   12    4                                                 
CONECT   24    8    9                                                 
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   14                                                      
CONECT   39   17                                                      
CONECT   40   20                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
