COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.221   1.717  -2.104  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.959   1.370  -0.991  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.882   1.378  -2.183  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.273   0.689  -1.149  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.000   0.335  -0.031  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.350   0.679   0.059  1.00  0.00           C  
HETATM    7  C   UNL     1       0.602  -1.459  -0.042  1.00  0.00           C  
HETATM    8  C   UNL     1       0.369  -0.295   0.678  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.947   0.041   1.050  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.557  -2.856  -0.453  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.856  -3.798  -1.103  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.556  -3.457  -1.072  1.00  0.00           C  
HETATM   13  C   UNL     1       1.872   1.559   1.574  1.00  0.00           C  
HETATM   14  C   UNL     1       4.581  -1.339  -0.489  1.00  0.00           C  
HETATM   15  C   UNL     1       6.092  -1.123  -0.387  1.00  0.00           C  
HETATM   16  C   UNL     1       5.673   1.333  -0.247  1.00  0.00           C  
HETATM   17  C   UNL     1       4.173   1.046  -0.352  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.336  -0.416   1.094  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.968  -0.768   0.706  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.737  -1.927  -0.011  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.471  -2.271  -0.382  1.00  0.00           N  
HETATM   22  O   UNL     1      -1.161   1.061   1.683  1.00  0.00           O  
HETATM   23  N   UNL     1       1.918  -1.541  -0.259  1.00  0.00           N  
HETATM   24  C   UNL     1       2.527  -0.502   0.273  1.00  0.00           C  
HETATM   25  N   UNL     1       1.607   0.302   0.868  1.00  0.00           N  
HETATM   26  N   UNL     1       3.882  -0.268   0.234  1.00  0.00           N  
HETATM   27  C   UNL     1       6.450   0.240  -0.986  1.00  0.00           C  
HETATM   28  N   UNL     1       6.499  -1.162   1.023  1.00  0.00           N  
HETATM   29  C   UNL     1       1.804   2.680   0.622  1.00  0.00           C  
HETATM   30  C   UNL     1       1.750   3.574  -0.137  1.00  0.00           C  
HETATM   31  C   UNL     1       1.682   4.694  -1.089  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.109   0.316   1.217  1.00  0.00           C  
HETATM   33  N   UNL     1      -6.712   0.027   2.135  1.00  0.00           N  
HETATM   34  H   UNL     1      -5.691   2.251  -2.917  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.005   1.632  -0.932  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.309   1.653  -3.057  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.228   0.428  -1.218  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.267  -4.680  -1.572  1.00  0.00           H  
HETATM   39  H   UNL     1       0.265  -4.008  -1.506  1.00  0.00           H  
HETATM   40  H   UNL     1       1.126   1.701   2.356  1.00  0.00           H  
HETATM   41  H   UNL     1       2.865   1.522   2.022  1.00  0.00           H  
HETATM   42  H   UNL     1       4.281  -1.324  -1.537  1.00  0.00           H  
HETATM   43  H   UNL     1       4.321  -2.303  -0.051  1.00  0.00           H  
HETATM   44  H   UNL     1       6.610  -1.909  -0.937  1.00  0.00           H  
HETATM   45  H   UNL     1       5.891   2.302  -0.696  1.00  0.00           H  
HETATM   46  H   UNL     1       5.968   1.344   0.803  1.00  0.00           H  
HETATM   47  H   UNL     1       3.618   1.814   0.185  1.00  0.00           H  
HETATM   48  H   UNL     1       3.876   1.049  -1.401  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.310   0.212   1.985  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.899  -1.325   1.306  1.00  0.00           H  
HETATM   51  H   UNL     1       7.520   0.416  -0.877  1.00  0.00           H  
HETATM   52  H   UNL     1       6.183   0.255  -2.043  1.00  0.00           H  
HETATM   53  H   UNL     1       7.494  -1.022   1.117  1.00  0.00           H  
HETATM   54  H   UNL     1       5.986  -0.484   1.567  1.00  0.00           H  
HETATM   55  H   UNL     1       1.879   5.629  -0.564  1.00  0.00           H  
HETATM   56  H   UNL     1       2.428   4.553  -1.871  1.00  0.00           H  
HETATM   57  H   UNL     1       0.689   4.731  -1.536  1.00  0.00           H  
CONECT    1    3    2    2   34                                       
CONECT    2    1    1    6   35                                       
CONECT    3    4    4    1   36                                       
CONECT    4    3    3    5   37                                       
CONECT    5    4   18    6    6                                       
CONECT    6    5    5    2   32                                       
CONECT    7   23    8    8   21                                       
CONECT    8   25    7    7    9                                       
CONECT    9    8   22   22   19                                       
CONECT   10   20   20   11                                            
CONECT   11   12   12   10   38                                       
CONECT   12   21   11   11   39                                       
CONECT   13   29   25   40   41                                       
CONECT   14   15   26   42   43                                       
CONECT   15   28   27   14   44                                       
CONECT   16   27   17   45   46                                       
CONECT   17   16   26   47   48                                       
CONECT   18   19    5   49   50                                       
CONECT   19    9   20   18                                            
CONECT   20   21   19   10   10                                       
CONECT   21    7   12   20                                            
CONECT   22    9    9                                                 
CONECT   23   24   24    7                                            
CONECT   24   26   25   23   23                                       
CONECT   25   13   24    8                                            
CONECT   26   14   17   24                                            
CONECT   27   15   16   51   52                                       
CONECT   28   15   53   54                                            
CONECT   29   30   30   30   13                                       
CONECT   30   31   29   29   29                                       
CONECT   31   30   55   56   57                                       
CONECT   32    6   33   33   33                                       
CONECT   33   32   32   32                                            
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
