COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.136   5.023  -0.174  1.00  0.00           C  
HETATM    2  C   UNL     1       0.881  -1.156  -1.063  1.00  0.00           C  
HETATM    3  C   UNL     1       1.432  -2.532   0.826  1.00  0.00           C  
HETATM    4  C   UNL     1       1.193   4.147  -0.018  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.354   2.379   0.478  1.00  0.00           C  
HETATM    6  C   UNL     1       1.813  -1.560  -0.092  1.00  0.00           C  
HETATM    7  C   UNL     1       3.173  -0.968  -0.084  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.744  -2.670  -0.163  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.406   3.258   0.324  1.00  0.00           C  
HETATM   10  C   UNL     1       0.951   2.818   0.306  1.00  0.00           C  
HETATM   11  C   UNL     1       3.541   0.317  -0.354  1.00  0.00           C  
HETATM   12  C   UNL     1       4.415  -1.618   0.173  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.824   2.787   0.518  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.034   1.476  -0.244  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.086   0.311   0.746  1.00  0.00           C  
HETATM   16  C   UNL     1       4.638  -3.075   0.490  1.00  0.00           C  
HETATM   17  N   UNL     1      -2.993  -2.429   0.680  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.162   4.578  -0.008  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.382  -1.710  -1.090  1.00  0.00           C  
HETATM   20  C   UNL     1       0.166  -3.083   0.791  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.127  -3.267  -0.196  1.00  0.00           C  
HETATM   22  C   UNL     1       2.640   1.470  -0.724  1.00  0.00           C  
HETATM   23  N   UNL     1       5.338  -0.707   0.066  1.00  0.00           N  
HETATM   24  O   UNL     1      -5.136  -1.325   0.254  1.00  0.00           O  
HETATM   25  O   UNL     1      -3.326  -1.219  -1.429  1.00  0.00           O  
HETATM   26  O   UNL     1       4.874   0.370  -0.221  1.00  0.00           O  
HETATM   27  O   UNL     1       1.985   1.950   0.451  1.00  0.00           O  
HETATM   28  S   UNL     1      -3.764  -1.154  -0.079  1.00  0.00           S  
HETATM   29  H   UNL     1       0.324   6.055  -0.430  1.00  0.00           H  
HETATM   30  H   UNL     1       1.157  -0.416  -1.798  1.00  0.00           H  
HETATM   31  H   UNL     1       2.128  -2.858   1.587  1.00  0.00           H  
HETATM   32  H   UNL     1       2.206   4.496  -0.148  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.544   1.348   0.741  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.012   2.624   1.580  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.514   3.541   0.139  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.973   1.524  -0.795  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.212   1.324  -0.942  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.080   0.092   1.105  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.721   0.579   1.591  1.00  0.00           H  
HETATM   40  H   UNL     1       4.794  -3.628  -0.436  1.00  0.00           H  
HETATM   41  H   UNL     1       5.517  -3.177   1.126  1.00  0.00           H  
HETATM   42  H   UNL     1       3.766  -3.471   1.009  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.101  -2.611   1.629  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.987   5.262  -0.137  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.089  -1.395  -1.844  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.111  -3.842   1.509  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.510  -3.270  -1.215  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.096  -4.289   0.186  1.00  0.00           H  
HETATM   49  H   UNL     1       3.245   2.275  -1.150  1.00  0.00           H  
HETATM   50  H   UNL     1       1.902   1.154  -1.455  1.00  0.00           H  
CONECT    1    4   18   18   29                                       
CONECT    2    6   19   19   30                                       
CONECT    3    6    6   20   31                                       
CONECT    4   10   10    1   32                                       
CONECT    5   10    9    9   33                                       
CONECT    6    7    3    3    2                                       
CONECT    7   12   11   11    6                                       
CONECT    8   20   20   19   21                                       
CONECT    9    5    5   18   13                                       
CONECT   10   27    4    4    5                                       
CONECT   11   26    7    7   22                                       
CONECT   12   23   23   16    7                                       
CONECT   13    9   14   34   35                                       
CONECT   14   13   15   36   37                                       
CONECT   15   14   28   38   39                                       
CONECT   16   12   40   41   42                                       
CONECT   17   21   28   43                                            
CONECT   18    1    1    9   44                                       
CONECT   19    2    2    8   45                                       
CONECT   20    3    8    8   46                                       
CONECT   21    8   17   47   48                                       
CONECT   22   11   27   49   50                                       
CONECT   23   26   12   12                                            
CONECT   24   28   28                                                 
CONECT   25   28   28                                                 
CONECT   26   23   11                                                 
CONECT   27   22   10                                                 
CONECT   28   15   17   24   24                                       
CONECT   28   25   25                                                 
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34   13                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
