COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.393  -5.017  -0.530  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.722  -3.743  -0.085  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.322  -1.413  -0.352  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.125  -1.411   0.353  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.597  -0.219   0.810  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.258   0.971   0.566  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.606   2.458  -0.615  1.00  0.00           C  
HETATM    8  C   UNL     1       0.326   1.887   0.242  1.00  0.00           C  
HETATM    9  C   UNL     1       1.411   1.207  -0.275  1.00  0.00           C  
HETATM   10  C   UNL     1       1.571   1.095  -1.648  1.00  0.00           C  
HETATM   11  C   UNL     1       3.465  -0.213  -1.286  1.00  0.00           C  
HETATM   12  C   UNL     1       3.057  -1.420  -0.709  1.00  0.00           C  
HETATM   13  C   UNL     1       3.861  -2.083   0.166  1.00  0.00           C  
HETATM   14  C   UNL     1       5.119  -1.551   0.497  1.00  0.00           C  
HETATM   15  C   UNL     1       5.974  -2.211   1.397  1.00  0.00           C  
HETATM   16  C   UNL     1       7.186  -1.668   1.695  1.00  0.00           C  
HETATM   17  C   UNL     1       7.595  -0.465   1.122  1.00  0.00           C  
HETATM   18  C   UNL     1       6.793   0.202   0.247  1.00  0.00           C  
HETATM   19  C   UNL     1       5.535  -0.328  -0.087  1.00  0.00           C  
HETATM   20  C   UNL     1       4.684   0.329  -0.990  1.00  0.00           C  
HETATM   21  C   UNL     1       0.640   1.666  -2.504  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.449   2.341  -1.989  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.450   0.971  -0.136  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.980  -0.216  -0.601  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.860  -2.619  -0.815  1.00  0.00           N  
HETATM   26  N   UNL     1      -1.707   3.147  -0.092  1.00  0.00           N  
HETATM   27  O   UNL     1      -4.059  -3.730   0.930  1.00  0.00           O  
HETATM   28  O   UNL     1      -3.682   3.360   1.372  1.00  0.00           O  
HETATM   29  O   UNL     1      -1.645   2.147   2.163  1.00  0.00           O  
HETATM   30  O   UNL     1       2.640   0.426  -2.156  1.00  0.00           O  
HETATM   31  S   UNL     1      -2.581   2.489   1.151  1.00  0.00           S  
HETATM   32  H   UNL     1      -5.170  -5.813   0.181  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.471  -4.863  -0.576  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.024  -5.297  -1.516  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.609  -2.340   0.545  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.666  -0.217   1.358  1.00  0.00           H  
HETATM   37  H   UNL     1       0.202   1.974   1.311  1.00  0.00           H  
HETATM   38  H   UNL     1       2.137   0.763   0.391  1.00  0.00           H  
HETATM   39  H   UNL     1       2.091  -1.832  -0.961  1.00  0.00           H  
HETATM   40  H   UNL     1       3.533  -3.014   0.604  1.00  0.00           H  
HETATM   41  H   UNL     1       5.671  -3.143   1.850  1.00  0.00           H  
HETATM   42  H   UNL     1       7.841  -2.177   2.387  1.00  0.00           H  
HETATM   43  H   UNL     1       8.561  -0.056   1.376  1.00  0.00           H  
HETATM   44  H   UNL     1       7.123   1.134  -0.189  1.00  0.00           H  
HETATM   45  H   UNL     1       4.987   1.262  -1.442  1.00  0.00           H  
HETATM   46  H   UNL     1       0.765   1.578  -3.573  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.176   2.782  -2.656  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.963   1.902  -0.325  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.910  -0.215  -1.149  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.332  -2.645  -1.663  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.957   4.009  -0.458  1.00  0.00           H  
CONECT    1    2   32   33   34                                       
CONECT    2   25    1   27   27                                       
CONECT    3   24   24    4   25                                       
CONECT    4    5    5    3   35                                       
CONECT    5    6    4    4   36                                       
CONECT    6   31   23   23    5                                       
CONECT    7    8   26   22   22                                       
CONECT    8    9    9    7   37                                       
CONECT    9    8    8   10   38                                       
CONECT   10    9   30   21   21                                       
CONECT   11   12   12   20   30                                       
CONECT   12   13   11   11   39                                       
CONECT   13   14   14   12   40                                       
CONECT   14   15   13   13   19                                       
CONECT   15   16   16   14   41                                       
CONECT   16   15   15   17   42                                       
CONECT   17   16   18   18   43                                       
CONECT   18   17   17   19   44                                       
CONECT   19   14   18   20   20                                       
CONECT   20   19   19   11   45                                       
CONECT   21   10   10   22   46                                       
CONECT   22    7    7   21   47                                       
CONECT   23    6    6   24   48                                       
CONECT   24   23    3    3   49                                       
CONECT   25    3    2   50                                            
CONECT   26   31    7   51                                            
CONECT   27    2    2                                                 
CONECT   28   31   31                                                 
CONECT   29   31   31                                                 
CONECT   30   11   10                                                 
CONECT   31   28   28   29   29                                       
CONECT   31   26    6                                                 
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
