COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.312  -2.381   0.290  1.00  0.00           C  
HETATM    2  C   UNL     1       1.977  -0.785   0.177  1.00  0.00           C  
HETATM    3  C   UNL     1       3.096   1.404  -0.216  1.00  0.00           C  
HETATM    4  C   UNL     1       3.342  -2.662   1.015  1.00  0.00           C  
HETATM    5  C   UNL     1       4.241   2.168  -0.333  1.00  0.00           C  
HETATM    6  C   UNL     1       5.493   1.566  -0.199  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.252   0.868  -0.038  1.00  0.00           C  
HETATM    8  C   UNL     1       5.589   0.204   0.047  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.626  -0.622  -0.996  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.868  -0.016  -1.045  1.00  0.00           C  
HETATM   11  C   UNL     1       4.582  -2.043   0.412  1.00  0.00           C  
HETATM   12  C   UNL     1       5.774   3.781  -0.174  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.147   0.549   1.064  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.388   1.145   1.012  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.753   2.451   0.906  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.254  -1.197  -3.073  1.00  0.00           C  
HETATM   17  N   UNL     1       2.108  -2.123   0.465  1.00  0.00           N  
HETATM   18  C   UNL     1       1.039  -2.963   0.199  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.429  -0.987   0.118  1.00  0.00           C  
HETATM   20  C   UNL     1       0.739  -0.216  -0.002  1.00  0.00           C  
HETATM   21  C   UNL     1       3.197   0.034   0.036  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.760  -0.347   0.064  1.00  0.00           C  
HETATM   23  C   UNL     1       4.449  -0.569   0.162  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.461  -3.199   0.537  1.00  0.00           C  
HETATM   25  N   UNL     1      -2.372  -3.849   0.734  1.00  0.00           N  
HETATM   26  N   UNL     1       1.221  -4.223  -0.121  1.00  0.00           N  
HETATM   27  O   UNL     1       4.420   3.499  -0.572  1.00  0.00           O  
HETATM   28  O   UNL     1       6.453   2.524  -0.350  1.00  0.00           O  
HETATM   29  O   UNL     1      -5.472   1.462  -0.088  1.00  0.00           O  
HETATM   30  O   UNL     1      -4.714  -0.282  -2.076  1.00  0.00           O  
HETATM   31  C   UNL     1      -6.815   3.417   0.377  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.271   1.767   2.173  1.00  0.00           C  
HETATM   33  H   UNL     1       2.125   1.865  -0.318  1.00  0.00           H  
HETATM   34  H   UNL     1       3.369  -3.739   0.844  1.00  0.00           H  
HETATM   35  H   UNL     1       3.345  -2.480   2.089  1.00  0.00           H  
HETATM   36  H   UNL     1       6.561  -0.255   0.149  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.327  -1.307  -1.775  1.00  0.00           H  
HETATM   38  H   UNL     1       5.423  -2.216   1.084  1.00  0.00           H  
HETATM   39  H   UNL     1       4.790  -2.530  -0.541  1.00  0.00           H  
HETATM   40  H   UNL     1       6.211   4.546  -0.816  1.00  0.00           H  
HETATM   41  H   UNL     1       5.809   4.092   0.871  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.478   0.763   1.884  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.689   1.831   1.791  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.842   3.003   1.137  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.024  -1.321  -3.835  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.346  -0.808  -3.533  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.043  -2.162  -2.611  1.00  0.00           H  
HETATM   48  H   UNL     1       0.663   0.836  -0.232  1.00  0.00           H  
HETATM   49  H   UNL     1       0.458  -4.793  -0.303  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.029   4.171   1.135  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.446   3.904  -0.525  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.726   2.865   0.146  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.515   1.079   2.549  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.485   2.521   2.930  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.182   1.215   1.942  1.00  0.00           H  
CONECT    1   18   24   19   19                                       
CONECT    2   17   21   20   20                                       
CONECT    3    5    5   21   33                                       
CONECT    4   11   17   34   35                                       
CONECT    5    6   27    3    3                                       
CONECT    6   28    8    8    5                                       
CONECT    7   14   10   10   29                                       
CONECT    8    6    6   23   36                                       
CONECT    9   22   22   10   37                                       
CONECT   10    9    7    7   30                                       
CONECT   11    4   23   38   39                                       
CONECT   12   28   27   40   41                                       
CONECT   13   22   14   14   42                                       
CONECT   14   13   13    7   43                                       
CONECT   15   29   32   31   44                                       
CONECT   16   30   45   46   47                                       
CONECT   17    4   18    2                                            
CONECT   18   26   26   17    1                                       
CONECT   19    1    1   20   22                                       
CONECT   20    2    2   19   48                                       
CONECT   21   23   23    3    2                                       
CONECT   22   19   13    9    9                                       
CONECT   23    8   11   21   21                                       
CONECT   24    1   25   25   25                                       
CONECT   25   24   24   24                                            
CONECT   26   18   18   49                                            
CONECT   27   12    5                                                 
CONECT   28   12    6                                                 
CONECT   29    7   15                                                 
CONECT   30   10   16                                                 
CONECT   31   15   50   51   52                                       
CONECT   32   15   53   54   55                                       
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   20                                                      
CONECT   49   26                                                      
CONECT   50   31                                                      
CONECT   51   31                                                      
CONECT   52   31                                                      
CONECT   53   32                                                      
CONECT   54   32                                                      
CONECT   55   32                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
