COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.467   0.665  -0.030  1.00  0.00           N  
HETATM    2  N   UNL     1       2.358  -1.739  -0.589  1.00  0.00           N  
HETATM    3  C   UNL     1       5.749  -0.243  -0.686  1.00  0.00           C  
HETATM    4  C   UNL     1       7.815   2.506   1.358  1.00  0.00           C  
HETATM    5  C   UNL     1       8.792   3.505   1.980  1.00  0.00           C  
HETATM    6  C   UNL     1       4.354  -0.528  -0.270  1.00  0.00           C  
HETATM    7  C   UNL     1       3.593  -1.480  -0.953  1.00  0.00           C  
HETATM    8  C   UNL     1       2.480  -0.150   1.162  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.639  -1.469   0.097  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.476  -0.245   0.421  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.660   2.112  -2.063  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.038  -3.504   1.593  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.239  -4.034   0.171  1.00  0.00           C  
HETATM   14  C   UNL     1       7.711   0.917  -0.405  1.00  0.00           C  
HETATM   15  C   UNL     1       3.784   0.150   0.810  1.00  0.00           C  
HETATM   16  C   UNL     1       0.389  -1.442   0.801  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.399  -0.573  -0.861  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.976   1.027  -1.229  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.218   1.704  -2.372  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.707  -2.616   0.392  1.00  0.00           C  
HETATM   21  C   UNL     1       8.265   0.233  -1.484  1.00  0.00           C  
HETATM   22  C   UNL     1       6.309  -0.924  -1.765  1.00  0.00           C  
HETATM   23  C   UNL     1       1.785  -1.113   0.432  1.00  0.00           C  
HETATM   24  N   UNL     1       7.551  -0.667  -2.135  1.00  0.00           N  
HETATM   25  N   UNL     1      -0.292  -2.371   0.101  1.00  0.00           N  
HETATM   26  N   UNL     1      -3.758  -1.268   0.770  1.00  0.00           N  
HETATM   27  N   UNL     1      -5.675   0.121   1.012  1.00  0.00           N  
HETATM   28  O   UNL     1       8.447   1.842   0.261  1.00  0.00           O  
HETATM   29  O   UNL     1      -0.143  -0.874   1.734  1.00  0.00           O  
HETATM   30  O   UNL     1      -5.516   2.487   0.461  1.00  0.00           O  
HETATM   31  O   UNL     1      -7.636   1.532   1.307  1.00  0.00           O  
HETATM   32  S   UNL     1      -3.726   0.586  -0.871  1.00  0.00           S  
HETATM   33  S   UNL     1      -6.493   1.454   0.467  1.00  0.00           S  
HETATM   34  H   UNL     1       7.521   1.771   2.107  1.00  0.00           H  
HETATM   35  H   UNL     1       6.931   3.036   1.002  1.00  0.00           H  
HETATM   36  H   UNL     1       8.310   4.012   2.816  1.00  0.00           H  
HETATM   37  H   UNL     1       9.676   2.976   2.336  1.00  0.00           H  
HETATM   38  H   UNL     1       9.086   4.241   1.231  1.00  0.00           H  
HETATM   39  H   UNL     1       4.025  -2.010  -1.790  1.00  0.00           H  
HETATM   40  H   UNL     1       2.008   0.354   1.992  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.433   1.796  -2.764  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.819   3.083  -1.594  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.930  -3.260   2.169  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.203  -3.907   2.166  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.536  -4.784  -0.191  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.263  -4.137  -0.187  1.00  0.00           H  
HETATM   47  H   UNL     1       4.348   0.891   1.357  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.541  -0.560  -1.516  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.300  -0.003  -1.380  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.042   1.120  -3.275  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.428   2.407  -2.105  1.00  0.00           H  
HETATM   52  H   UNL     1       9.280   0.440  -1.789  1.00  0.00           H  
HETATM   53  H   UNL     1       5.728  -1.661  -2.299  1.00  0.00           H  
HETATM   54  H   UNL     1       0.155  -2.877  -0.595  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.036  -0.403   1.744  1.00  0.00           H  
CONECT    1   14    3    3                                            
CONECT    2    7    7   23                                            
CONECT    3    1    1   22    6                                       
CONECT    4    5   28   34   35                                       
CONECT    5    4   36   37   38                                       
CONECT    6    7    3   15   15                                       
CONECT    7    2    2    6   39                                       
CONECT    8   23   23   15   40                                       
CONECT    9   17   17   26   20                                       
CONECT   10   32   27   26   26                                       
CONECT   11   19   18   41   42                                       
CONECT   12   20   13   43   44                                       
CONECT   13   20   12   45   46                                       
CONECT   14   28   21   21    1                                       
CONECT   15    6    6    8   47                                       
CONECT   16   25   23   29   29                                       
CONECT   17   32    9    9   48                                       
CONECT   18   11   19   33   49                                       
CONECT   19   11   18   50   51                                       
CONECT   20    9   25   12   13                                       
CONECT   21   14   14   24   52                                       
CONECT   22   24   24    3   53                                       
CONECT   23    2   16    8    8                                       
CONECT   24   21   22   22                                            
CONECT   25   20   16   54                                            
CONECT   26   10   10    9                                            
CONECT   27   33   10   55                                            
CONECT   28    4   14                                                 
CONECT   29   16   16                                                 
CONECT   30   33   33                                                 
CONECT   31   33   33                                                 
CONECT   32   10   17                                                 
CONECT   33   18   30   30   31                                       
CONECT   33   31   27                                                 
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   25                                                      
CONECT   55   27                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
