COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.494   2.739  -0.747  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.809   0.570  -0.053  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.071  -0.751   0.311  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.028  -1.604   0.650  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.728  -1.150   0.628  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.456   0.176   0.262  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.510   1.033  -0.084  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.075   0.662   0.238  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.043  -0.209  -0.036  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.327  -1.553  -0.438  1.00  0.00           C  
HETATM   11  C   UNL     1       0.352   0.243   0.086  1.00  0.00           C  
HETATM   12  C   UNL     1       2.679  -0.183  -0.066  1.00  0.00           C  
HETATM   13  C   UNL     1       5.111   0.245   0.038  1.00  0.00           C  
HETATM   14  C   UNL     1       6.617   0.297   0.038  1.00  0.00           C  
HETATM   15  C   UNL     1       7.091   1.366  -0.948  1.00  0.00           C  
HETATM   16  C   UNL     1       7.116   0.642   1.443  1.00  0.00           C  
HETATM   17  C   UNL     1       7.174  -1.066  -0.380  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.553  -2.620  -0.758  1.00  0.00           N  
HETATM   19  N   UNL     1       1.362  -0.609  -0.181  1.00  0.00           N  
HETATM   20  N   UNL     1       3.074   1.006   0.289  1.00  0.00           N  
HETATM   21  N   UNL     1       4.315   1.220   0.340  1.00  0.00           N  
HETATM   22  O   UNL     1      -6.835   1.400  -0.384  1.00  0.00           O  
HETATM   23  O   UNL     1      -7.351  -1.205   0.336  1.00  0.00           O  
HETATM   24  O   UNL     1       0.594   1.385   0.428  1.00  0.00           O  
HETATM   25  S   UNL     1       4.120  -1.157  -0.368  1.00  0.00           S  
HETATM   26  H   UNL     1      -5.983   3.223   0.085  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.838   2.724  -1.617  1.00  0.00           H  
HETATM   28  H   UNL     1      -7.402   3.293  -0.987  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.237  -2.625   0.932  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.920  -1.815   0.892  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.306   2.055  -0.367  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.866   1.703   0.434  1.00  0.00           H  
HETATM   33  H   UNL     1       8.181   1.403  -0.948  1.00  0.00           H  
HETATM   34  H   UNL     1       6.736   1.120  -1.949  1.00  0.00           H  
HETATM   35  H   UNL     1       6.694   2.336  -0.651  1.00  0.00           H  
HETATM   36  H   UNL     1       6.778  -0.119   2.146  1.00  0.00           H  
HETATM   37  H   UNL     1       8.205   0.680   1.443  1.00  0.00           H  
HETATM   38  H   UNL     1       6.719   1.613   1.741  1.00  0.00           H  
HETATM   39  H   UNL     1       6.837  -1.827   0.323  1.00  0.00           H  
HETATM   40  H   UNL     1       6.819  -1.312  -1.380  1.00  0.00           H  
HETATM   41  H   UNL     1       8.264  -1.028  -0.380  1.00  0.00           H  
HETATM   42  H   UNL     1       1.169  -1.520  -0.454  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.650  -1.584  -0.502  1.00  0.00           H  
CONECT    1   22   26   27   28                                       
CONECT    2    3    3    7   22                                       
CONECT    3    4   23    2    2                                       
CONECT    4    5    5    3   29                                       
CONECT    5    4    4    6   30                                       
CONECT    6    5    8    7    7                                       
CONECT    7    6    6    2   31                                       
CONECT    8    6    9    9   32                                       
CONECT    9    8    8   11   10                                       
CONECT   10    9   18   18   18                                       
CONECT   11   24   24    9   19                                       
CONECT   12   25   19   20   20                                       
CONECT   13   14   25   21   21                                       
CONECT   14   17   15   16   13                                       
CONECT   15   14   33   34   35                                       
CONECT   16   14   36   37   38                                       
CONECT   17   14   39   40   41                                       
CONECT   18   10   10   10                                            
CONECT   19   11   12   42                                            
CONECT   20   12   12   21                                            
CONECT   21   13   13   20                                            
CONECT   22    2    1                                                 
CONECT   23    3   43                                                 
CONECT   24   11   11                                                 
CONECT   25   13   12                                                 
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   23                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
