COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.147  -0.681   1.538  1.00  0.00           C  
HETATM    2  N   UNL     1       5.095  -0.359   0.110  1.00  0.00           N  
HETATM    3  C   UNL     1       4.010   0.253  -0.404  1.00  0.00           C  
HETATM    4  O   UNL     1       3.967   0.520  -1.587  1.00  0.00           O  
HETATM    5  C   UNL     1       2.849   0.605   0.490  1.00  0.00           C  
HETATM    6  C   UNL     1       1.757   1.286  -0.337  1.00  0.00           C  
HETATM    7  C   UNL     1       0.578   1.644   0.570  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.460   2.434  -0.229  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.692   2.685   0.643  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.730   3.476  -0.156  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.129   4.815  -0.589  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.897   4.563  -1.461  1.00  0.00           C  
HETATM   13  C   UNL     1       0.141   3.773  -0.661  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.033   0.415   1.084  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.509  -0.629   0.164  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.831  -1.138   0.687  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.760  -1.686  -0.168  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.970  -2.151   0.330  1.00  0.00           C  
HETATM   19  O   UNL     1      -4.888  -2.693  -0.514  1.00  0.00           O  
HETATM   20  C   UNL     1      -5.878  -1.888  -0.981  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.821  -2.389  -1.868  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.826  -1.568  -2.342  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.893  -0.249  -1.934  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.955   0.253  -1.050  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.952  -0.565  -0.569  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.245  -2.064   1.688  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.318  -1.515   2.550  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.101  -1.045   2.055  1.00  0.00           C  
HETATM   29  N   UNL     1      -1.175  -0.495   2.901  1.00  0.00           N  
HETATM   30  C   UNL     1      -0.169   0.211   2.438  1.00  0.00           C  
HETATM   31  N   UNL     1       0.748   0.751   3.306  1.00  0.00           N  
HETATM   32  C   UNL     1       6.224  -0.701  -0.759  1.00  0.00           C  
HETATM   33  C   UNL     1       7.484   0.012  -0.264  1.00  0.00           C  
HETATM   34  C   UNL     1       8.662  -0.346  -1.172  1.00  0.00           C  
HETATM   35  C   UNL     1       8.888  -1.859  -1.143  1.00  0.00           C  
HETATM   36  C   UNL     1       7.628  -2.572  -1.637  1.00  0.00           C  
HETATM   37  C   UNL     1       6.449  -2.214  -0.730  1.00  0.00           C  
HETATM   38  H   UNL     1       5.585   0.155   2.084  1.00  0.00           H  
HETATM   39  H   UNL     1       4.137  -0.865   1.905  1.00  0.00           H  
HETATM   40  H   UNL     1       5.756  -1.572   1.688  1.00  0.00           H  
HETATM   41  H   UNL     1       2.450  -0.303   0.942  1.00  0.00           H  
HETATM   42  H   UNL     1       3.187   1.284   1.273  1.00  0.00           H  
HETATM   43  H   UNL     1       2.156   2.194  -0.790  1.00  0.00           H  
HETATM   44  H   UNL     1       1.419   0.608  -1.121  1.00  0.00           H  
HETATM   45  H   UNL     1       0.933   2.250   1.404  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.750   1.864  -1.112  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.120   1.732   0.951  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.402   3.256   1.526  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.019   2.906  -1.039  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.607   3.655   0.465  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.868   5.378  -1.158  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.839   5.385   0.294  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.187   3.993  -2.343  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.469   5.517  -1.769  1.00  0.00           H  
HETATM   55  H   UNL     1       0.431   4.343   0.221  1.00  0.00           H  
HETATM   56  H   UNL     1       1.019   3.594  -1.282  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.644  -0.209  -0.833  1.00  0.00           H  
HETATM   58  H   UNL     1       0.212  -1.445   0.126  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.548  -1.755  -1.225  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.768  -3.419  -2.188  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.559  -1.958  -3.033  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.679   0.391  -2.306  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.010   1.284  -0.734  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.222  -0.174   0.125  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.187  -2.427   2.071  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.534  -1.448   3.606  1.00  0.00           H  
HETATM   67  H   UNL     1       1.451   1.329   2.970  1.00  0.00           H  
HETATM   68  H   UNL     1       0.693   0.554   4.254  1.00  0.00           H  
HETATM   69  H   UNL     1       6.005  -0.387  -1.780  1.00  0.00           H  
HETATM   70  H   UNL     1       7.323   1.090  -0.286  1.00  0.00           H  
HETATM   71  H   UNL     1       7.702  -0.303   0.756  1.00  0.00           H  
HETATM   72  H   UNL     1       8.443  -0.031  -2.193  1.00  0.00           H  
HETATM   73  H   UNL     1       9.560   0.162  -0.820  1.00  0.00           H  
HETATM   74  H   UNL     1       9.727  -2.114  -1.789  1.00  0.00           H  
HETATM   75  H   UNL     1       9.106  -2.174  -0.122  1.00  0.00           H  
HETATM   76  H   UNL     1       7.409  -2.257  -2.658  1.00  0.00           H  
HETATM   77  H   UNL     1       7.788  -3.650  -1.616  1.00  0.00           H  
HETATM   78  H   UNL     1       6.668  -2.529   0.291  1.00  0.00           H  
HETATM   79  H   UNL     1       5.552  -2.722  -1.082  1.00  0.00           H  
CONECT    1    2   38   39   40                                       
CONECT    2    1   32    3                                            
CONECT    3    2    5    4    4                                       
CONECT    4    3    3                                                 
CONECT    5    3    6   41   42                                       
CONECT    6    5    7   43   44                                       
CONECT    7    6   14    8   45                                       
CONECT    8    7   13    9   46                                       
CONECT    9    8   10   47   48                                       
CONECT   10    9   11   49   50                                       
CONECT   11   10   12   51   52                                       
CONECT   12   11   13   53   54                                       
CONECT   13    8   12   55   56                                       
CONECT   14    7   30   15                                            
CONECT   15   14   16   57   58                                       
CONECT   16   15   28   17   17                                       
CONECT   17   16   16   18   59                                       
CONECT   18   17   26   26   19                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   25   25                                       
CONECT   21   20   22   22   60                                       
CONECT   22   21   21   23   61                                       
CONECT   23   22   24   24   62                                       
CONECT   24   23   23   25   63                                       
CONECT   25   20   20   24   64                                       
CONECT   26   18   18   27   65                                       
CONECT   27   26   28   28   66                                       
CONECT   28   16   27   27   29                                       
CONECT   29   28   30   30                                            
CONECT   30   14   29   29   31                                       
CONECT   31   30   67   68                                            
CONECT   32    2   37   33   69                                       
CONECT   33   32   34   70   71                                       
CONECT   34   33   35   72   73                                       
CONECT   35   34   36   74   75                                       
CONECT   36   35   37   76   77                                       
CONECT   37   32   36   78   79                                       
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   12                                                      
CONECT   55   13                                                      
CONECT   56   13                                                      
CONECT   57   15                                                      
CONECT   58   15                                                      
CONECT   59   17                                                      
CONECT   60   21                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   25                                                      
CONECT   65   26                                                      
CONECT   66   27                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   32                                                      
CONECT   70   33                                                      
CONECT   71   33                                                      
CONECT   72   34                                                      
CONECT   73   34                                                      
CONECT   74   35                                                      
CONECT   75   35                                                      
CONECT   76   36                                                      
CONECT   77   36                                                      
CONECT   78   37                                                      
CONECT   79   37                                                      
MASTER        0    0    0    0    0    0    0    0   79    0   79    0
END
