COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.482  -0.915  -1.721  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.828  -0.709  -1.479  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.251  -0.287  -0.227  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.633   1.192  -0.539  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.844  -1.069   0.225  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.160   0.952  -0.880  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.319  -0.071   0.786  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.973  -0.278   0.542  1.00  0.00           C  
HETATM    9  C   UNL     1       7.232  -0.395  -0.254  1.00  0.00           C  
HETATM   10  C   UNL     1       4.997  -1.173   0.245  1.00  0.00           C  
HETATM   11  C   UNL     1       4.508   0.107   0.016  1.00  0.00           C  
HETATM   12  C   UNL     1       6.745   0.874  -0.475  1.00  0.00           C  
HETATM   13  C   UNL     1       1.245   1.676   1.040  1.00  0.00           C  
HETATM   14  C   UNL     1       0.764  -0.127  -0.326  1.00  0.00           C  
HETATM   15  C   UNL     1       3.057   0.384   0.153  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.723   0.544   3.005  1.00  0.00           C  
HETATM   17  C   UNL     1       5.388   1.135  -0.342  1.00  0.00           C  
HETATM   18  C   UNL     1       6.361  -1.429   0.105  1.00  0.00           C  
HETATM   19  C   UNL     1       2.112  -0.423  -0.481  1.00  0.00           C  
HETATM   20  N   UNL     1       0.377   0.898   0.419  1.00  0.00           N  
HETATM   21  C   UNL     1       2.600   1.453   0.933  1.00  0.00           C  
HETATM   22  C   UNL     1       6.869  -2.749   0.328  1.00  0.00           C  
HETATM   23  O   UNL     1       4.914   2.388  -0.561  1.00  0.00           O  
HETATM   24  C   UNL     1       5.868   3.388  -0.924  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.553  -0.701  -0.713  1.00  0.00           C  
HETATM   26  O   UNL     1      -3.733   0.343   2.014  1.00  0.00           O  
HETATM   27  N   UNL     1      -5.615  -0.077   0.018  1.00  0.00           N  
HETATM   28  O   UNL     1      -8.347  -0.044  -0.637  1.00  0.00           O  
HETATM   29  C   UNL     1      -6.372  -1.331  -0.108  1.00  0.00           C  
HETATM   30  N   UNL     1      -0.191  -0.916  -0.959  1.00  0.00           N  
HETATM   31  N   UNL     1       7.272  -3.796   0.505  1.00  0.00           N  
HETATM   32  H   UNL     1      -2.155  -1.248  -2.695  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.549  -0.876  -2.264  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.713   1.580   0.477  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.056   1.913  -1.238  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.930  -0.747   1.263  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.418  -1.983   0.078  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.075   0.616  -1.913  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.601   1.880  -0.752  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.249  -0.112   1.326  1.00  0.00           H  
HETATM   41  H   UNL     1       8.288  -0.593  -0.362  1.00  0.00           H  
HETATM   42  H   UNL     1       4.322  -1.969   0.522  1.00  0.00           H  
HETATM   43  H   UNL     1       7.422   1.670  -0.751  1.00  0.00           H  
HETATM   44  H   UNL     1       0.887   2.502   1.637  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.190  -0.391   3.175  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.022   1.304   2.660  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.187   0.873   3.935  1.00  0.00           H  
HETATM   48  H   UNL     1       2.424  -1.264  -1.081  1.00  0.00           H  
HETATM   49  H   UNL     1       3.302   2.096   1.445  1.00  0.00           H  
HETATM   50  H   UNL     1       6.365   3.097  -1.850  1.00  0.00           H  
HETATM   51  H   UNL     1       5.358   4.341  -1.069  1.00  0.00           H  
HETATM   52  H   UNL     1       6.608   3.490  -0.131  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.969  -2.070   0.583  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.291  -1.704  -1.129  1.00  0.00           H  
HETATM   55  H   UNL     1       0.087  -1.615  -1.572  1.00  0.00           H  
CONECT    1    2   25   25   32                                       
CONECT    2    3    3    1   33                                       
CONECT    3   27    2    2    7                                       
CONECT    4   28    6   34   35                                       
CONECT    5   28   29   36   37                                       
CONECT    6    4   27   38   39                                       
CONECT    7    3   26    8    8                                       
CONECT    8    7    7   25   40                                       
CONECT    9   12   12   18   41                                       
CONECT   10   18   18   11   42                                       
CONECT   11   17   17   10   15                                       
CONECT   12    9    9   17   43                                       
CONECT   13   21   21   20   44                                       
CONECT   14   19   30   20   20                                       
CONECT   15   11   19   19   21                                       
CONECT   16   26   45   46   47                                       
CONECT   17   12   23   11   11                                       
CONECT   18    9   22   10   10                                       
CONECT   19   15   15   14   48                                       
CONECT   20   14   14   13                                            
CONECT   21   15   13   13   49                                       
CONECT   22   18   31   31   31                                       
CONECT   23   24   17                                                 
CONECT   24   23   50   51   52                                       
CONECT   25    1    1    8   30                                       
CONECT   26    7   16                                                 
CONECT   27   29    6    3                                            
CONECT   28    5    4                                                 
CONECT   29    5   27   53   54                                       
CONECT   30   25   14   55                                            
CONECT   31   22   22   22                                            
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
