COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.169  -1.397   0.212  1.00  0.00           C  
HETATM    2  C   UNL     1       1.526  -5.244  -0.021  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.525  -1.619   0.068  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.412  -0.539   0.090  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.256   0.670   1.038  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.123   0.815   0.063  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.996   1.022  -1.341  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.413   1.599  -1.398  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.670   1.251   0.958  1.00  0.00           C  
HETATM   10  C   UNL     1       0.421  -3.423   1.281  1.00  0.00           C  
HETATM   11  C   UNL     1       1.495  -4.512   1.324  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.764  -0.441  -0.024  1.00  0.00           N  
HETATM   13  N   UNL     1      -5.422   1.274  -0.011  1.00  0.00           N  
HETATM   14  C   UNL     1       0.319  -0.098   0.379  1.00  0.00           C  
HETATM   15  N   UNL     1       0.720  -2.480   0.196  1.00  0.00           N  
HETATM   16  O   UNL     1       1.514   2.212  -0.196  1.00  0.00           O  
HETATM   17  C   UNL     1       2.234   1.304   0.176  1.00  0.00           C  
HETATM   18  C   UNL     1       3.685   1.500   0.246  1.00  0.00           C  
HETATM   19  C   UNL     1       4.389   2.675  -0.083  1.00  0.00           C  
HETATM   20  N   UNL     1       3.991   3.870  -0.521  1.00  0.00           N  
HETATM   21  C   UNL     1       4.863   4.825  -0.760  1.00  0.00           C  
HETATM   22  C   UNL     1       6.229   4.596  -0.555  1.00  0.00           C  
HETATM   23  C   UNL     1       6.641   3.382  -0.109  1.00  0.00           C  
HETATM   24  N   UNL     1       5.712   2.412   0.129  1.00  0.00           N  
HETATM   25  N   UNL     1       5.827   1.094   0.583  1.00  0.00           N  
HETATM   26  C   UNL     1       4.639   0.554   0.660  1.00  0.00           C  
HETATM   27  N   UNL     1       1.697   0.118   0.524  1.00  0.00           N  
HETATM   28  C   UNL     1      -0.553   0.977   0.402  1.00  0.00           C  
HETATM   29  C   UNL     1       0.709  -3.151  -1.110  1.00  0.00           C  
HETATM   30  C   UNL     1       1.792  -4.232  -1.138  1.00  0.00           C  
HETATM   31  C   UNL     1       2.638  -6.295  -0.005  1.00  0.00           C  
HETATM   32  O   UNL     1       2.592  -7.056  -1.214  1.00  0.00           O  
HETATM   33  C   UNL     1      -1.916   0.763   0.258  1.00  0.00           C  
HETATM   34  N   UNL     1      -3.021   1.602   0.238  1.00  0.00           N  
HETATM   35  C   UNL     1      -3.008   3.060   0.377  1.00  0.00           C  
HETATM   36  O   UNL     1      -8.199   1.024  -0.352  1.00  0.00           O  
HETATM   37  H   UNL     1       0.567  -5.732  -0.192  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.898  -2.624  -0.061  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.827   0.891   2.016  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.297  -0.410   0.895  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.033  -0.052  -1.524  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.377   1.500  -2.101  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.370   2.681  -1.269  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.863   1.365  -2.363  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.306   0.764   1.697  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.635   2.322   1.156  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.553  -3.881   1.106  1.00  0.00           H  
HETATM   48  H   UNL     1       0.406  -2.890   2.232  1.00  0.00           H  
HETATM   49  H   UNL     1       1.264  -5.221   2.119  1.00  0.00           H  
HETATM   50  H   UNL     1       2.467  -4.057   1.512  1.00  0.00           H  
HETATM   51  H   UNL     1       4.525   5.788  -1.114  1.00  0.00           H  
HETATM   52  H   UNL     1       6.948   5.378  -0.751  1.00  0.00           H  
HETATM   53  H   UNL     1       7.690   3.187   0.055  1.00  0.00           H  
HETATM   54  H   UNL     1       4.426  -0.455   0.981  1.00  0.00           H  
HETATM   55  H   UNL     1       2.264  -0.587   0.875  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.173   1.979   0.532  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.266  -3.610  -1.273  1.00  0.00           H  
HETATM   58  H   UNL     1       0.903  -2.421  -1.895  1.00  0.00           H  
HETATM   59  H   UNL     1       2.769  -3.773  -0.988  1.00  0.00           H  
HETATM   60  H   UNL     1       1.773  -4.741  -2.102  1.00  0.00           H  
HETATM   61  H   UNL     1       3.606  -5.799   0.075  1.00  0.00           H  
HETATM   62  H   UNL     1       2.499  -6.959   0.848  1.00  0.00           H  
HETATM   63  H   UNL     1       3.270  -7.742  -1.273  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.824   3.516  -0.596  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.972   3.398   0.760  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.219   3.352   1.070  1.00  0.00           H  
CONECT    1   14   15    3    3                                       
CONECT    2   30   31   11   37                                       
CONECT    3    1    1    4   38                                       
CONECT    4   33   33    3   12                                       
CONECT    5   13    9   39   40                                       
CONECT    6   34   12   12   13                                       
CONECT    7    8   13   41   42                                       
CONECT    8    7   36   43   44                                       
CONECT    9   36    5   45   46                                       
CONECT   10   15   11   47   48                                       
CONECT   11    2   10   49   50                                       
CONECT   12    4    6    6                                            
CONECT   13    7    6    5                                            
CONECT   14   27   28   28    1                                       
CONECT   15   29    1   10                                            
CONECT   16   17   17                                                 
CONECT   17   18   16   16   27                                       
CONECT   18   26   19   19   17                                       
CONECT   19   24   18   18   20                                       
CONECT   20   21   21   19                                            
CONECT   21   22   20   20   51                                       
CONECT   22   23   23   21   52                                       
CONECT   23   22   22   24   53                                       
CONECT   24   23   25   19                                            
CONECT   25   24   26   26                                            
CONECT   26   25   25   18   54                                       
CONECT   27   17   14   55                                            
CONECT   28   14   14   33   56                                       
CONECT   29   30   15   57   58                                       
CONECT   30   29    2   59   60                                       
CONECT   31   32    2   61   62                                       
CONECT   32   31   63                                                 
CONECT   33   28    4    4   34                                       
CONECT   34   33   35    6                                            
CONECT   35   34   64   65   66                                       
CONECT   36    8    9                                                 
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   11                                                      
CONECT   50   11                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   32                                                      
CONECT   64   35                                                      
CONECT   65   35                                                      
CONECT   66   35                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
