COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.571   0.910   0.013  1.00  0.00           C  
HETATM    2  C   UNL     1       9.064  -0.384  -0.063  1.00  0.00           C  
HETATM    3  C   UNL     1       8.191  -1.454  -0.136  1.00  0.00           C  
HETATM    4  C   UNL     1       4.308   1.523   0.032  1.00  0.00           C  
HETATM    5  C   UNL     1       5.262   2.449   0.791  1.00  0.00           C  
HETATM    6  C   UNL     1       6.624   2.519   0.103  1.00  0.00           C  
HETATM    7  C   UNL     1       4.227  -0.992  -0.136  1.00  0.00           C  
HETATM    8  C   UNL     1       2.071   0.053   0.027  1.00  0.00           C  
HETATM    9  C   UNL     1       0.604  -0.358  -0.115  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.277   0.851   0.072  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.529  -0.077   0.550  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.717  -0.008  -0.205  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.582  -0.535   1.849  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.735   0.444  -1.535  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.791  -0.929   2.417  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.925   0.481  -2.197  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.145  -0.410  -0.894  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.478   1.930  -0.006  1.00  0.00           C  
HETATM   19  C   UNL     1       6.825  -1.228  -0.132  1.00  0.00           C  
HETATM   20  C   UNL     1       6.320   0.059  -0.055  1.00  0.00           C  
HETATM   21  C   UNL     1       7.219   1.136   0.022  1.00  0.00           C  
HETATM   22  N   UNL     1       4.930   0.180  -0.054  1.00  0.00           N  
HETATM   23  S   UNL     1       5.421  -2.298  -0.211  1.00  0.00           S  
HETATM   24  O   UNL     1       0.387  -0.908  -1.415  1.00  0.00           O  
HETATM   25  C   UNL     1       0.263  -1.406   0.946  1.00  0.00           C  
HETATM   26  O   UNL     1       0.188   1.876   0.524  1.00  0.00           O  
HETATM   27  N   UNL     1      -4.314   0.310  -0.013  1.00  0.00           N  
HETATM   28  C   UNL     1      -7.944  -0.407   0.386  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.393  -0.831  -0.110  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.713   1.417   0.743  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.954  -0.873   1.710  1.00  0.00           C  
HETATM   32  C   UNL     1      -9.116  -0.330  -0.384  1.00  0.00           C  
HETATM   33  N   UNL     1      -9.058   0.104  -1.622  1.00  0.00           N  
HETATM   34  N   UNL     1      -1.581   0.793  -0.262  1.00  0.00           N  
HETATM   35  N   UNL     1       2.927  -1.122  -0.155  1.00  0.00           N  
HETATM   36  H   UNL     1       9.256   1.744   0.071  1.00  0.00           H  
HETATM   37  H   UNL     1      10.130  -0.556  -0.065  1.00  0.00           H  
HETATM   38  H   UNL     1       8.574  -2.463  -0.197  1.00  0.00           H  
HETATM   39  H   UNL     1       3.360   1.455   0.567  1.00  0.00           H  
HETATM   40  H   UNL     1       4.136   1.914  -0.971  1.00  0.00           H  
HETATM   41  H   UNL     1       4.832   3.449   0.835  1.00  0.00           H  
HETATM   42  H   UNL     1       5.392   2.071   1.805  1.00  0.00           H  
HETATM   43  H   UNL     1       6.502   2.918  -0.904  1.00  0.00           H  
HETATM   44  H   UNL     1       7.287   3.168   0.674  1.00  0.00           H  
HETATM   45  H   UNL     1       2.313   0.800  -0.729  1.00  0.00           H  
HETATM   46  H   UNL     1       2.236   0.473   1.019  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.675  -0.590   2.433  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.823   0.757  -2.022  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.806  -1.289   3.435  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.946   0.828  -3.220  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.410  -1.214  -0.871  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.415  -0.189  -1.926  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.783   2.376  -0.952  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.962   2.674   0.601  1.00  0.00           H  
HETATM   55  H   UNL     1       0.583  -0.297  -2.139  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.782  -1.699   0.845  1.00  0.00           H  
HETATM   57  H   UNL     1       0.900  -2.280   0.811  1.00  0.00           H  
HETATM   58  H   UNL     1       0.428  -0.986   1.938  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.887  -1.654  -0.627  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.104  -1.151   0.890  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.419   1.065   1.732  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.438   2.224   0.844  1.00  0.00           H  
HETATM   63  H   UNL     1      -8.881  -1.183   2.168  1.00  0.00           H  
HETATM   64  H   UNL     1     -10.063  -0.627   0.041  1.00  0.00           H  
CONECT    1   21   21    2   36                                       
CONECT    2    1    3    3   37                                       
CONECT    3    2    2   19   38                                       
CONECT    4    5   22   39   40                                       
CONECT    5    6    4   41   42                                       
CONECT    6    5   21   43   44                                       
CONECT    7   22   35   35   23                                       
CONECT    8    9   35   45   46                                       
CONECT    9   24   10   25    8                                       
CONECT   10   34    9   26   26                                       
CONECT   11   13   13   12   27                                       
CONECT   12   28   28   11   14                                       
CONECT   13   15   11   11   47                                       
CONECT   14   12   16   16   48                                       
CONECT   15   31   31   13   49                                       
CONECT   16   33   14   14   50                                       
CONECT   17   29   34   51   52                                       
CONECT   18   30   34   53   54                                       
CONECT   19   20   20    3   23                                       
CONECT   20   21   22   19   19                                       
CONECT   21    6    1    1   20                                       
CONECT   22    4   20    7                                            
CONECT   23    7   19                                                 
CONECT   24    9   55                                                 
CONECT   25    9   56   57   58                                       
CONECT   26   10   10                                                 
CONECT   27   11   29   30                                            
CONECT   28   31   32   12   12                                       
CONECT   29   27   17   59   60                                       
CONECT   30   27   18   61   62                                       
CONECT   31   15   15   28   63                                       
CONECT   32   28   33   33   64                                       
CONECT   33   32   32   16                                            
CONECT   34   17   18   10                                            
CONECT   35    8    7    7                                            
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   30                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
