COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.649   0.774   0.679  1.00  0.00           O  
HETATM    2  C   UNL     1       5.570   0.131  -0.595  1.00  0.00           C  
HETATM    3  C   UNL     1       6.857   0.392  -1.379  1.00  0.00           C  
HETATM    4  C   UNL     1       8.016  -0.264  -0.673  1.00  0.00           C  
HETATM    5  C   UNL     1       8.366  -1.565  -0.980  1.00  0.00           C  
HETATM    6  C   UNL     1       9.429  -2.167  -0.333  1.00  0.00           C  
HETATM    7  C   UNL     1      10.142  -1.467   0.622  1.00  0.00           C  
HETATM    8  C   UNL     1       9.793  -0.165   0.929  1.00  0.00           C  
HETATM    9  C   UNL     1       8.733   0.438   0.278  1.00  0.00           C  
HETATM   10  C   UNL     1       5.390  -1.375  -0.395  1.00  0.00           C  
HETATM   11  C   UNL     1       4.136  -1.630   0.402  1.00  0.00           C  
HETATM   12  C   UNL     1       3.006  -2.120  -0.225  1.00  0.00           C  
HETATM   13  C   UNL     1       1.857  -2.354   0.506  1.00  0.00           C  
HETATM   14  C   UNL     1       1.837  -2.098   1.865  1.00  0.00           C  
HETATM   15  C   UNL     1       2.968  -1.608   2.492  1.00  0.00           C  
HETATM   16  C   UNL     1       4.119  -1.379   1.761  1.00  0.00           C  
HETATM   17  C   UNL     1       4.377   0.689  -1.374  1.00  0.00           C  
HETATM   18  C   UNL     1       3.182   0.848  -0.432  1.00  0.00           C  
HETATM   19  C   UNL     1       2.025   1.511  -1.183  1.00  0.00           C  
HETATM   20  C   UNL     1       0.830   1.670  -0.240  1.00  0.00           C  
HETATM   21  C   UNL     1       1.193   2.642   0.884  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.366   2.217  -1.022  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.577   2.350  -0.110  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.552   1.227   0.928  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.808   3.670   0.587  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.019   3.496   1.520  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.272   3.082   0.750  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.796   1.212  -2.122  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.291   0.881  -1.851  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.774   2.110  -1.073  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.970   1.921  -0.187  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.712   0.820  -0.218  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.873   0.690   0.675  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.547  -0.454   0.728  1.00  0.00           C  
HETATM   35  C   UNL     1      -7.817  -0.563   1.541  1.00  0.00           C  
HETATM   36  C   UNL     1      -8.943  -1.058   0.626  1.00  0.00           C  
HETATM   37  O   UNL     1      -9.298  -0.029  -0.299  1.00  0.00           O  
HETATM   38  C   UNL     1      -6.060  -1.668  -0.030  1.00  0.00           C  
HETATM   39  C   UNL     1      -7.191  -2.162  -0.942  1.00  0.00           C  
HETATM   40  O   UNL     1      -6.852  -3.443  -1.476  1.00  0.00           O  
HETATM   41  C   UNL     1      -8.453  -2.275  -0.127  1.00  0.00           C  
HETATM   42  C   UNL     1      -9.117  -3.403  -0.075  1.00  0.00           C  
HETATM   43  H   UNL     1       5.764   1.733   0.629  1.00  0.00           H  
HETATM   44  H   UNL     1       6.762  -0.023  -2.382  1.00  0.00           H  
HETATM   45  H   UNL     1       7.032   1.465  -1.444  1.00  0.00           H  
HETATM   46  H   UNL     1       7.809  -2.112  -1.726  1.00  0.00           H  
HETATM   47  H   UNL     1       9.702  -3.184  -0.572  1.00  0.00           H  
HETATM   48  H   UNL     1      10.972  -1.937   1.129  1.00  0.00           H  
HETATM   49  H   UNL     1      10.349   0.382   1.676  1.00  0.00           H  
HETATM   50  H   UNL     1       8.460   1.456   0.517  1.00  0.00           H  
HETATM   51  H   UNL     1       5.308  -1.863  -1.367  1.00  0.00           H  
HETATM   52  H   UNL     1       6.249  -1.776   0.141  1.00  0.00           H  
HETATM   53  H   UNL     1       3.021  -2.320  -1.286  1.00  0.00           H  
HETATM   54  H   UNL     1       0.973  -2.736   0.016  1.00  0.00           H  
HETATM   55  H   UNL     1       0.939  -2.280   2.436  1.00  0.00           H  
HETATM   56  H   UNL     1       2.953  -1.408   3.553  1.00  0.00           H  
HETATM   57  H   UNL     1       5.003  -1.000   2.252  1.00  0.00           H  
HETATM   58  H   UNL     1       4.639   1.659  -1.795  1.00  0.00           H  
HETATM   59  H   UNL     1       4.115   0.002  -2.179  1.00  0.00           H  
HETATM   60  H   UNL     1       2.868  -0.133  -0.074  1.00  0.00           H  
HETATM   61  H   UNL     1       3.468   1.470   0.417  1.00  0.00           H  
HETATM   62  H   UNL     1       2.339   2.491  -1.540  1.00  0.00           H  
HETATM   63  H   UNL     1       1.739   0.889  -2.031  1.00  0.00           H  
HETATM   64  H   UNL     1       0.572   0.701   0.187  1.00  0.00           H  
HETATM   65  H   UNL     1       0.342   2.756   1.555  1.00  0.00           H  
HETATM   66  H   UNL     1       2.045   2.252   1.441  1.00  0.00           H  
HETATM   67  H   UNL     1       1.451   3.611   0.457  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.119   3.182  -1.465  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.705   1.371   1.600  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.478   1.243   1.503  1.00  0.00           H  
HETATM   71  H   UNL     1      -1.455   0.266   0.423  1.00  0.00           H  
HETATM   72  H   UNL     1      -0.928   3.940   1.170  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.016   4.446  -0.150  1.00  0.00           H  
HETATM   74  H   UNL     1      -2.788   2.731   2.261  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.212   4.439   2.030  1.00  0.00           H  
HETATM   76  H   UNL     1      -5.044   2.780   1.458  1.00  0.00           H  
HETATM   77  H   UNL     1      -4.631   3.930   0.167  1.00  0.00           H  
HETATM   78  H   UNL     1      -0.686   1.666  -3.107  1.00  0.00           H  
HETATM   79  H   UNL     1      -0.193   0.307  -2.059  1.00  0.00           H  
HETATM   80  H   UNL     1      -2.840   0.775  -2.787  1.00  0.00           H  
HETATM   81  H   UNL     1      -2.382  -0.021  -1.245  1.00  0.00           H  
HETATM   82  H   UNL     1      -2.912   2.960  -1.741  1.00  0.00           H  
HETATM   83  H   UNL     1      -4.462   0.019  -0.899  1.00  0.00           H  
HETATM   84  H   UNL     1      -6.179   1.525   1.289  1.00  0.00           H  
HETATM   85  H   UNL     1      -7.669  -1.271   2.356  1.00  0.00           H  
HETATM   86  H   UNL     1      -8.075   0.415   1.948  1.00  0.00           H  
HETATM   87  H   UNL     1      -9.812  -1.326   1.227  1.00  0.00           H  
HETATM   88  H   UNL     1     -10.006  -0.275  -0.910  1.00  0.00           H  
HETATM   89  H   UNL     1      -5.194  -1.400  -0.634  1.00  0.00           H  
HETATM   90  H   UNL     1      -5.786  -2.454   0.675  1.00  0.00           H  
HETATM   91  H   UNL     1      -7.339  -1.453  -1.757  1.00  0.00           H  
HETATM   92  H   UNL     1      -7.524  -3.815  -2.063  1.00  0.00           H  
HETATM   93  H   UNL     1     -10.023  -3.470   0.509  1.00  0.00           H  
HETATM   94  H   UNL     1      -8.758  -4.266  -0.617  1.00  0.00           H  
CONECT    1    2   43                                                 
CONECT    2   17    3    1   10                                       
CONECT    3    4    2   44   45                                       
CONECT    4    5    5    9    3                                       
CONECT    5    6    4    4   46                                       
CONECT    6    7    7    5   47                                       
CONECT    7    6    6    8   48                                       
CONECT    8    7    9    9   49                                       
CONECT    9    8    8    4   50                                       
CONECT   10    2   11   51   52                                       
CONECT   11   10   12   12   16                                       
CONECT   12   11   11   13   53                                       
CONECT   13   12   14   14   54                                       
CONECT   14   13   13   15   55                                       
CONECT   15   16   16   14   56                                       
CONECT   16   11   15   15   57                                       
CONECT   17   18    2   58   59                                       
CONECT   18   19   17   60   61                                       
CONECT   19   20   18   62   63                                       
CONECT   20   22   21   19   64                                       
CONECT   21   20   65   66   67                                       
CONECT   22   28   23   20   68                                       
CONECT   23   24   30   22   25                                       
CONECT   24   23   69   70   71                                       
CONECT   25   26   23   72   73                                       
CONECT   26   27   25   74   75                                       
CONECT   27   31   26   76   77                                       
CONECT   28   29   22   78   79                                       
CONECT   29   30   28   80   81                                       
CONECT   30   31   29   23   82                                       
CONECT   31   32   32   27   30                                       
CONECT   32   33   31   31   83                                       
CONECT   33   34   34   32   84                                       
CONECT   34   35   38   33   33                                       
CONECT   35   36   34   85   86                                       
CONECT   36   37   41   35   87                                       
CONECT   37   36   88                                                 
CONECT   38   39   34   89   90                                       
CONECT   39   41   40   38   91                                       
CONECT   40   39   92                                                 
CONECT   41   42   42   36   39                                       
CONECT   42   41   41   93   94                                       
CONECT   43    1                                                      
CONECT   44    3                                                      
CONECT   45    3                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   10                                                      
CONECT   53   12                                                      
CONECT   54   13                                                      
CONECT   55   14                                                      
CONECT   56   15                                                      
CONECT   57   16                                                      
CONECT   58   17                                                      
CONECT   59   17                                                      
CONECT   60   18                                                      
CONECT   61   18                                                      
CONECT   62   19                                                      
CONECT   63   19                                                      
CONECT   64   20                                                      
CONECT   65   21                                                      
CONECT   66   21                                                      
CONECT   67   21                                                      
CONECT   68   22                                                      
CONECT   69   24                                                      
CONECT   70   24                                                      
CONECT   71   24                                                      
CONECT   72   25                                                      
CONECT   73   25                                                      
CONECT   74   26                                                      
CONECT   75   26                                                      
CONECT   76   27                                                      
CONECT   77   27                                                      
CONECT   78   28                                                      
CONECT   79   28                                                      
CONECT   80   29                                                      
CONECT   81   29                                                      
CONECT   82   30                                                      
CONECT   83   32                                                      
CONECT   84   33                                                      
CONECT   85   35                                                      
CONECT   86   35                                                      
CONECT   87   36                                                      
CONECT   88   37                                                      
CONECT   89   38                                                      
CONECT   90   38                                                      
CONECT   91   39                                                      
CONECT   92   40                                                      
CONECT   93   42                                                      
CONECT   94   42                                                      
MASTER        0    0    0    0    0    0    0    0   94    0   94    0
END
