COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.887  -0.276   8.273  1.00  0.00           C  
HETATM    2  C   UNL     1       1.750   0.803   8.269  1.00  0.00           C  
HETATM    3  C   UNL     1       2.560   1.045   9.363  1.00  0.00           C  
HETATM    4  C   UNL     1       2.507   0.207  10.461  1.00  0.00           C  
HETATM    5  C   UNL     1       1.644  -0.872  10.466  1.00  0.00           C  
HETATM    6  C   UNL     1       0.831  -1.111   9.374  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.025   0.553   6.967  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.360   0.272   7.191  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.305   1.276   7.086  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.914   2.561   6.758  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.579   2.842   6.535  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.634   1.839   6.644  1.00  0.00           C  
HETATM   13  C   UNL     1       0.004  -0.540   7.081  1.00  0.00           C  
HETATM   14  C   UNL     1       0.857  -0.572   5.812  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.039  -0.840   4.601  1.00  0.00           C  
HETATM   16  N   UNL     1       0.779  -0.870   3.382  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.136  -1.130   2.264  1.00  0.00           C  
HETATM   18  C   UNL     1       0.654  -1.175   0.955  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.300  -1.446  -0.208  1.00  0.00           C  
HETATM   20  N   UNL     1       0.459  -1.489  -1.465  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.510  -1.750  -2.536  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.650  -3.260  -2.740  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.030  -1.113  -3.815  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.946  -0.669  -4.750  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.507  -0.078  -5.924  1.00  0.00           C  
HETATM   26  C   UNL     1       0.856   0.056  -6.163  1.00  0.00           C  
HETATM   27  C   UNL     1       1.769  -0.390  -5.221  1.00  0.00           C  
HETATM   28  C   UNL     1       1.324  -0.974  -4.050  1.00  0.00           C  
HETATM   29  O   UNL     1      -1.407   0.358  -6.845  1.00  0.00           O  
HETATM   30  C   UNL     1      -2.706   0.071  -6.322  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.771   0.540  -7.316  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.161   0.233  -6.756  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.226   0.703  -7.749  1.00  0.00           C  
HETATM   34  O   UNL     1       1.292   0.630  -7.316  1.00  0.00           O  
HETATM   35  C   UNL     1       2.720   0.629  -7.264  1.00  0.00           C  
HETATM   36  C   UNL     1       3.278   1.265  -8.538  1.00  0.00           C  
HETATM   37  C   UNL     1       4.807   1.264  -8.482  1.00  0.00           C  
HETATM   38  C   UNL     1       5.365   1.901  -9.757  1.00  0.00           C  
HETATM   39  H   UNL     1       1.791   1.457   7.411  1.00  0.00           H  
HETATM   40  H   UNL     1       3.235   1.888   9.359  1.00  0.00           H  
HETATM   41  H   UNL     1       3.141   0.395  11.315  1.00  0.00           H  
HETATM   42  H   UNL     1       1.603  -1.527  11.323  1.00  0.00           H  
HETATM   43  H   UNL     1       0.156  -1.955   9.378  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.665  -0.731   7.447  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.348   1.056   7.260  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.652   3.345   6.676  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.274   3.846   6.279  1.00  0.00           H  
HETATM   48  H   UNL     1       0.408   2.059   6.470  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.497  -1.500   7.206  1.00  0.00           H  
HETATM   50  H   UNL     1       1.602  -1.364   5.894  1.00  0.00           H  
HETATM   51  H   UNL     1       1.359   0.387   5.687  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.784  -0.048   4.519  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.541  -1.799   4.726  1.00  0.00           H  
HETATM   54  H   UNL     1       1.381  -1.677   3.457  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.880  -0.335   2.212  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.637  -2.086   2.419  1.00  0.00           H  
HETATM   57  H   UNL     1       1.398  -1.970   1.008  1.00  0.00           H  
HETATM   58  H   UNL     1       1.155  -0.219   0.801  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.043  -0.650  -0.261  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.800  -2.401  -0.053  1.00  0.00           H  
HETATM   61  H   UNL     1       1.059  -2.298  -1.413  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.477  -1.330  -2.261  1.00  0.00           H  
HETATM   63  H   UNL     1       0.317  -3.681  -3.015  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.997  -3.721  -1.815  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.370  -3.454  -3.535  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.005  -0.779  -4.564  1.00  0.00           H  
HETATM   67  H   UNL     1       2.828  -0.283  -5.403  1.00  0.00           H  
HETATM   68  H   UNL     1       2.037  -1.322  -3.317  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.805  -1.002  -6.164  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.839   0.592  -5.374  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.672   1.614  -7.474  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.637   0.020  -8.264  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.260  -0.840  -6.598  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.294   0.754  -5.808  1.00  0.00           H  
HETATM   75  H   UNL     1      -7.216   0.484  -7.351  1.00  0.00           H  
HETATM   76  H   UNL     1      -6.127   1.776  -7.907  1.00  0.00           H  
HETATM   77  H   UNL     1      -6.093   0.182  -8.698  1.00  0.00           H  
HETATM   78  H   UNL     1       3.080  -0.396  -7.182  1.00  0.00           H  
HETATM   79  H   UNL     1       3.052   1.201  -6.397  1.00  0.00           H  
HETATM   80  H   UNL     1       2.918   2.291  -8.620  1.00  0.00           H  
HETATM   81  H   UNL     1       2.946   0.694  -9.405  1.00  0.00           H  
HETATM   82  H   UNL     1       5.167   0.239  -8.400  1.00  0.00           H  
HETATM   83  H   UNL     1       5.139   1.836  -7.615  1.00  0.00           H  
HETATM   84  H   UNL     1       6.454   1.900  -9.717  1.00  0.00           H  
HETATM   85  H   UNL     1       5.032   1.329 -10.624  1.00  0.00           H  
HETATM   86  H   UNL     1       5.005   2.926  -9.839  1.00  0.00           H  
CONECT    1    2    2    6   13                                       
CONECT    2    1    1    3   39                                       
CONECT    3    2    4    4   40                                       
CONECT    4    3    3    5   41                                       
CONECT    5    4    6    6   42                                       
CONECT    6    1    5    5   43                                       
CONECT    7    8    8   12   13                                       
CONECT    8    7    7    9   44                                       
CONECT    9    8   10   10   45                                       
CONECT   10    9    9   11   46                                       
CONECT   11   10   12   12   47                                       
CONECT   12    7   11   11   48                                       
CONECT   13    1    7   14   49                                       
CONECT   14   13   15   50   51                                       
CONECT   15   14   16   52   53                                       
CONECT   16   15   17   54                                            
CONECT   17   16   18   55   56                                       
CONECT   18   17   19   57   58                                       
CONECT   19   18   20   59   60                                       
CONECT   20   19   21   61                                            
CONECT   21   20   22   23   62                                       
CONECT   22   21   63   64   65                                       
CONECT   23   21   24   24   28                                       
CONECT   24   23   23   25   66                                       
CONECT   25   24   26   26   29                                       
CONECT   26   25   25   27   34                                       
CONECT   27   26   28   28   67                                       
CONECT   28   23   27   27   68                                       
CONECT   29   25   30                                                 
CONECT   30   29   31   69   70                                       
CONECT   31   30   32   71   72                                       
CONECT   32   31   33   73   74                                       
CONECT   33   32   75   76   77                                       
CONECT   34   26   35                                                 
CONECT   35   34   36   78   79                                       
CONECT   36   35   37   80   81                                       
CONECT   37   36   38   82   83                                       
CONECT   38   37   84   85   86                                       
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   17                                                      
CONECT   57   18                                                      
CONECT   58   18                                                      
CONECT   59   19                                                      
CONECT   60   19                                                      
CONECT   61   20                                                      
CONECT   62   21                                                      
CONECT   63   22                                                      
CONECT   64   22                                                      
CONECT   65   22                                                      
CONECT   66   24                                                      
CONECT   67   27                                                      
CONECT   68   28                                                      
CONECT   69   30                                                      
CONECT   70   30                                                      
CONECT   71   31                                                      
CONECT   72   31                                                      
CONECT   73   32                                                      
CONECT   74   32                                                      
CONECT   75   33                                                      
CONECT   76   33                                                      
CONECT   77   33                                                      
CONECT   78   35                                                      
CONECT   79   35                                                      
CONECT   80   36                                                      
CONECT   81   36                                                      
CONECT   82   37                                                      
CONECT   83   37                                                      
CONECT   84   38                                                      
CONECT   85   38                                                      
CONECT   86   38                                                      
MASTER        0    0    0    0    0    0    0    0   86    0   86    0
END
