COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -6.425   1.116   0.501  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.737  -1.484  -1.578  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.017  -1.640  -2.066  1.00  0.00           C  
HETATM    4  N   UNL     1      -6.450   3.270   0.623  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.104  -1.251  -1.303  1.00  0.00           C  
HETATM    6  O   UNL     1      -1.000  -0.290   1.326  1.00  0.00           O  
HETATM    7  C   UNL     1       1.250  -0.969   0.002  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.169  -0.766   0.221  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.539  -0.937  -0.309  1.00  0.00           C  
HETATM   10  N   UNL     1       3.536  -0.695  -0.900  1.00  0.00           N  
HETATM   11  C   UNL     1       1.076  -3.426   2.962  1.00  0.00           C  
HETATM   12  C   UNL     1       0.709  -2.218   2.098  1.00  0.00           C  
HETATM   13  C   UNL     1       1.617  -2.177   0.867  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.639  -0.551   0.458  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.915  -0.703  -0.047  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.104  -0.286   0.779  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.277   1.578  -0.465  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.278   2.922  -0.373  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.940   2.193   1.155  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.108  -1.138  -0.522  1.00  0.00           N  
HETATM   21  C   UNL     1       2.221  -0.858  -1.144  1.00  0.00           C  
HETATM   22  O   UNL     1       1.819  -0.914  -2.287  1.00  0.00           O  
HETATM   23  C   UNL     1       4.501  -0.585  -2.004  1.00  0.00           C  
HETATM   24  C   UNL     1       5.120   0.817  -1.973  1.00  0.00           C  
HETATM   25  C   UNL     1       5.503   1.157  -0.548  1.00  0.00           C  
HETATM   26  C   UNL     1       5.034   0.533   0.549  1.00  0.00           C  
HETATM   27  C   UNL     1       4.044  -0.618   0.477  1.00  0.00           C  
HETATM   28  S   UNL     1       6.627   2.426  -0.079  1.00  0.00           S  
HETATM   29  C   UNL     1       6.398   2.048   1.621  1.00  0.00           C  
HETATM   30  C   UNL     1       5.537   1.042   1.742  1.00  0.00           C  
HETATM   31  H   UNL     1      -1.889  -1.788  -2.174  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.172  -2.066  -3.046  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.105  -1.375  -1.690  1.00  0.00           H  
HETATM   34  H   UNL     1       1.295  -0.063   0.606  1.00  0.00           H  
HETATM   35  H   UNL     1       0.945  -4.340   2.383  1.00  0.00           H  
HETATM   36  H   UNL     1       2.116  -3.343   3.279  1.00  0.00           H  
HETATM   37  H   UNL     1       0.430  -3.455   3.839  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.330  -2.301   1.780  1.00  0.00           H  
HETATM   39  H   UNL     1       0.840  -1.304   2.676  1.00  0.00           H  
HETATM   40  H   UNL     1       1.485  -3.091   0.288  1.00  0.00           H  
HETATM   41  H   UNL     1       2.656  -2.094   1.184  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.493  -0.127   1.440  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.871  -0.403   1.837  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.960  -0.912   0.524  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.839   0.981  -1.167  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.844   3.600  -0.995  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.239   2.168   1.976  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.243  -1.518  -1.405  1.00  0.00           H  
HETATM   49  H   UNL     1       5.285  -1.333  -1.882  1.00  0.00           H  
HETATM   50  H   UNL     1       3.990  -0.741  -2.954  1.00  0.00           H  
HETATM   51  H   UNL     1       6.008   0.837  -2.604  1.00  0.00           H  
HETATM   52  H   UNL     1       4.395   1.543  -2.340  1.00  0.00           H  
HETATM   53  H   UNL     1       3.220  -0.440   1.168  1.00  0.00           H  
HETATM   54  H   UNL     1       4.544  -1.552   0.732  1.00  0.00           H  
HETATM   55  H   UNL     1       6.882   2.555   2.443  1.00  0.00           H  
HETATM   56  H   UNL     1       5.248   0.646   2.704  1.00  0.00           H  
CONECT    1   17   19   16                                            
CONECT    2    9    3    3   31                                       
CONECT    3    2    2    5   32                                       
CONECT    4   18   19   19                                            
CONECT    5   15   15    3   33                                       
CONECT    6    8    8                                                 
CONECT    7   21   13   20   34                                       
CONECT    8    6    6   20    9                                       
CONECT    9    8   14   14    2                                       
CONECT   10   27   23   21                                            
CONECT   11   12   35   36   37                                       
CONECT   12   13   11   38   39                                       
CONECT   13    7   12   40   41                                       
CONECT   14    9    9   15   42                                       
CONECT   15   14   16    5    5                                       
CONECT   16    1   15   43   44                                       
CONECT   17   18   18    1   45                                       
CONECT   18    4   17   17   46                                       
CONECT   19    4    4    1   47                                       
CONECT   20    7    8   48                                            
CONECT   21   10   22   22    7                                       
CONECT   22   21   21                                                 
CONECT   23   24   10   49   50                                       
CONECT   24   25   23   51   52                                       
CONECT   25   28   26   26   24                                       
CONECT   26   30   25   25   27                                       
CONECT   27   26   10   53   54                                       
CONECT   28   29   25                                                 
CONECT   29   30   30   28   55                                       
CONECT   30   29   29   26   56                                       
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   27                                                      
CONECT   54   27                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
