COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.816   1.392  -1.051  1.00  0.00           C  
HETATM    2  C   UNL     1       0.518  -3.226   0.353  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.023  -4.663  -1.587  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.760  -2.680  -0.357  1.00  0.00           C  
HETATM    5  CA  UNL     1      -3.262   0.487   1.633  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.486   1.204   1.060  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.243   3.133  -0.387  1.00  0.00           C  
HETATM    8  O   UNL     1       0.925   1.264  -0.369  1.00  0.00           O  
HETATM    9  C   UNL     1       1.572   0.241  -0.263  1.00  0.00           C  
HETATM   10  O   UNL     1       2.909   0.302  -0.121  1.00  0.00           O  
HETATM   11  C   UNL     1       3.511   1.624  -0.103  1.00  0.00           C  
HETATM   12  C   UNL     1       5.003   1.494   0.062  1.00  0.00           C  
HETATM   13  C   UNL     1       5.559   1.477   1.328  1.00  0.00           C  
HETATM   14  C   UNL     1       6.928   1.358   1.480  1.00  0.00           C  
HETATM   15  C   UNL     1       7.741   1.256   0.366  1.00  0.00           C  
HETATM   16  C   UNL     1       7.185   1.273  -0.899  1.00  0.00           C  
HETATM   17  N   UNL     1       0.951  -0.954  -0.287  1.00  0.00           N  
HETATM   18  C   UNL     1       1.610  -2.266  -0.169  1.00  0.00           C  
HETATM   19  C   UNL     1       0.737  -4.622  -0.251  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.652  -3.271  -1.781  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.496  -1.164  -0.436  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.231  -0.459   0.675  1.00  0.00           C  
HETATM   23  N   UNL     1      -2.547  -0.198   0.553  1.00  0.00           N  
HETATM   24  C   UNL     1      -4.030   2.312   0.109  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.585   2.420  -1.714  1.00  0.00           C  
HETATM   26  N   UNL     1      -4.332   1.798  -2.158  1.00  0.00           N  
HETATM   27  C   UNL     1      -3.443   1.719  -1.153  1.00  0.00           C  
HETATM   28  O   UNL     1      -2.331   1.243  -1.244  1.00  0.00           O  
HETATM   29  C   UNL     1      -3.712  -0.537   2.676  1.00  0.00           C  
HETATM   30  O   UNL     1      -4.669  -1.423   2.092  1.00  0.00           O  
HETATM   31  O   UNL     1      -0.637  -0.127   1.680  1.00  0.00           O  
HETATM   32  H   UNL     1       5.381   1.401  -2.040  1.00  0.00           H  
HETATM   33  H   UNL     1       0.437  -3.230   1.440  1.00  0.00           H  
HETATM   34  H   UNL     1       0.668  -4.877  -2.402  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.803  -5.424  -1.549  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.686  -2.931   0.159  1.00  0.00           H  
HETATM   37  HA  UNL     1      -2.600   1.216   2.101  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.103   0.489   0.515  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.066   1.639   1.874  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.073   3.066   0.317  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.966   4.172  -0.563  1.00  0.00           H  
HETATM   42  H   UNL     1       3.293   2.135  -1.041  1.00  0.00           H  
HETATM   43  H   UNL     1       3.102   2.198   0.728  1.00  0.00           H  
HETATM   44  H   UNL     1       4.924   1.556   2.198  1.00  0.00           H  
HETATM   45  H   UNL     1       7.363   1.345   2.468  1.00  0.00           H  
HETATM   46  H   UNL     1       8.810   1.163   0.485  1.00  0.00           H  
HETATM   47  H   UNL     1       7.820   1.193  -1.769  1.00  0.00           H  
HETATM   48  H   UNL     1       2.435  -2.211   0.542  1.00  0.00           H  
HETATM   49  H   UNL     1       1.970  -2.597  -1.142  1.00  0.00           H  
HETATM   50  H   UNL     1       1.800  -4.789  -0.424  1.00  0.00           H  
HETATM   51  H   UNL     1       0.344  -5.383   0.422  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.009  -2.648  -2.402  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.641  -3.362  -2.229  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.827  -0.781  -1.401  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.022  -0.463  -0.251  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.306   2.961   0.601  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.346   1.658  -1.548  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.929   3.143  -2.453  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.166   1.483  -3.060  1.00  0.00           H  
HETATM   60  H1  UNL     1      -2.850  -1.109   3.020  1.00  0.00           H  
HETATM   61  H2  UNL     1      -4.165  -0.019   3.522  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.999  -2.101   2.698  1.00  0.00           H  
CONECT    1   12   12   16   32                                       
CONECT    2    4   18   19   33                                       
CONECT    3   19   20   34   35                                       
CONECT    4    2   21   36   20                                       
CONECT    5    6   23   29   37                                       
CONECT    6    5   24   38   39                                       
CONECT    7   24   25   40   41                                       
CONECT    8    9    9                                                 
CONECT    9    8    8   10   17                                       
CONECT   10    9   11                                                 
CONECT   11   10   12   42   43                                       
CONECT   12    1    1   11   13                                       
CONECT   13   12   14   14   44                                       
CONECT   14   13   13   15   45                                       
CONECT   15   14   16   16   46                                       
CONECT   16    1   15   15   47                                       
CONECT   17    9   18   21                                            
CONECT   18    2   17   48   49                                       
CONECT   19    2    3   50   51                                       
CONECT   20    3   52   53    4                                       
CONECT   21    4   17   22   54                                       
CONECT   22   21   23   31   31                                       
CONECT   23    5   22   55                                            
CONECT   24    6    7   27   56                                       
CONECT   25    7   26   57   58                                       
CONECT   26   25   27   59                                            
CONECT   27   24   26   28   28                                       
CONECT   28   27   27                                                 
CONECT   29    5   30   60   61                                       
CONECT   30   29   62                                                 
CONECT   31   22   22                                                 
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   30                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
