COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.742  -2.504  -1.837  1.00  0.00           O  
HETATM    2  C   UNL     1       3.516  -2.155  -0.968  1.00  0.00           C  
HETATM    3  C   UNL     1       4.693  -3.031  -0.632  1.00  0.00           C  
HETATM    4  C   UNL     1       5.832  -2.154  -0.102  1.00  0.00           C  
HETATM    5  C   UNL     1       5.315  -1.360   1.099  1.00  0.00           C  
HETATM    6  C   UNL     1       4.129  -0.526   0.683  1.00  0.00           C  
HETATM    7  C   UNL     1       3.300  -0.938  -0.299  1.00  0.00           C  
HETATM    8  C   UNL     1       2.109  -0.105  -0.702  1.00  0.00           C  
HETATM    9  C   UNL     1       2.256   1.310  -0.226  1.00  0.00           C  
HETATM   10  C   UNL     1       1.458   2.324  -0.805  1.00  0.00           C  
HETATM   11  O   UNL     1       0.421   2.843  -0.116  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.343   3.863  -0.762  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.467   4.325   0.167  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.419   3.263   0.348  1.00  0.00           O  
HETATM   15  C   UNL     1      -3.719   3.878   0.477  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.684   5.019  -0.572  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.219   5.510  -0.468  1.00  0.00           C  
HETATM   18  O   UNL     1       1.707   2.728  -1.926  1.00  0.00           O  
HETATM   19  C   UNL     1       3.133   1.633   0.741  1.00  0.00           C  
HETATM   20  C   UNL     1       3.248   3.064   1.199  1.00  0.00           C  
HETATM   21  N   UNL     1       3.913   0.666   1.320  1.00  0.00           N  
HETATM   22  C   UNL     1       0.862  -0.702  -0.101  1.00  0.00           C  
HETATM   23  C   UNL     1       0.745  -0.814   1.276  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.389  -1.357   1.841  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.159  -1.129  -0.922  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.311  -1.680  -0.364  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.429  -1.800   1.028  1.00  0.00           C  
HETATM   28  N   UNL     1      -2.654  -2.374   1.315  1.00  0.00           N  
HETATM   29  C   UNL     1      -3.151  -2.658   2.663  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.925  -1.447   3.187  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.343  -2.641   0.145  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.556  -2.221  -0.938  1.00  0.00           C  
HETATM   33  C   UNL     1      -3.025  -2.374  -2.240  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.267  -2.930  -2.461  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.050  -3.337  -1.391  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.593  -3.204  -0.097  1.00  0.00           C  
HETATM   37  H   UNL     1       4.403  -3.753   0.131  1.00  0.00           H  
HETATM   38  H   UNL     1       5.023  -3.557  -1.528  1.00  0.00           H  
HETATM   39  H   UNL     1       6.666  -2.783   0.206  1.00  0.00           H  
HETATM   40  H   UNL     1       6.158  -1.466  -0.883  1.00  0.00           H  
HETATM   41  H   UNL     1       5.015  -2.050   1.888  1.00  0.00           H  
HETATM   42  H   UNL     1       6.105  -0.706   1.470  1.00  0.00           H  
HETATM   43  H   UNL     1       0.305   4.708  -0.996  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.772   3.468  -1.683  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.053   4.622   1.131  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.507   3.164   0.241  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.896   4.637  -1.570  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.156   6.390   0.172  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.819   5.729  -1.459  1.00  0.00           H  
HETATM   50  H   UNL     1       2.529   3.250   1.996  1.00  0.00           H  
HETATM   51  H   UNL     1       4.257   3.247   1.569  1.00  0.00           H  
HETATM   52  H   UNL     1       3.043   3.731   0.361  1.00  0.00           H  
HETATM   53  H   UNL     1       1.548  -0.472   1.912  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.470  -1.440   2.915  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.067  -1.036  -1.994  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.811  -3.525   2.632  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.310  -2.865   3.325  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.295  -1.658   4.190  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.266  -0.580   3.218  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.767  -1.240   2.526  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.418  -2.057  -3.075  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.632  -3.049  -3.470  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.022  -3.771  -1.573  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.211  -3.522   0.729  1.00  0.00           H  
HETATM   65  H   UNL     1       2.019  -0.110  -1.788  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.854   4.283   1.480  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.380   5.814  -0.305  1.00  0.00           H  
HETATM   68  H   UNL     1       4.325   0.832   2.183  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    7    3                                       
CONECT    3    2    4   37   38                                       
CONECT    4    3    5   39   40                                       
CONECT    5    4    6   41   42                                       
CONECT    6    7    7    5   21                                       
CONECT    7    2    8    6    6                                       
CONECT    8    7    9   22   65                                       
CONECT    9    8   10   19   19                                       
CONECT   10   11    9   18   18                                       
CONECT   11   10   12                                                 
CONECT   12   11   13   43   44                                       
CONECT   13   14   12   17   45                                       
CONECT   14   15   13                                                 
CONECT   15   14   16   46   66                                       
CONECT   16   15   17   47   67                                       
CONECT   17   13   16   48   49                                       
CONECT   18   10   10                                                 
CONECT   19    9    9   21   20                                       
CONECT   20   19   50   51   52                                       
CONECT   21    6   19   68                                            
CONECT   22   23    8   25   25                                       
CONECT   23   24   24   22   53                                       
CONECT   24   23   23   27   54                                       
CONECT   25   22   22   26   55                                       
CONECT   26   27   27   25   32                                       
CONECT   27   24   26   26   28                                       
CONECT   28   27   29   31                                            
CONECT   29   28   30   56   57                                       
CONECT   30   29   58   59   60                                       
CONECT   31   28   32   32   36                                       
CONECT   32   26   31   31   33                                       
CONECT   33   32   34   34   61                                       
CONECT   34   33   33   35   62                                       
CONECT   35   36   36   34   63                                       
CONECT   36   31   35   35   64                                       
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43   12                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   33                                                      
CONECT   62   34                                                      
CONECT   63   35                                                      
CONECT   64   36                                                      
CONECT   65    8                                                      
CONECT   66   15                                                      
CONECT   67   16                                                      
CONECT   68   21                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
