COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.282  -1.508   6.373  1.00  0.00           O  
HETATM    2  O   UNL     1      -4.030  -3.543   5.598  1.00  0.00           O  
HETATM    3  O   UNL     1      -3.276  -4.762   7.818  1.00  0.00           O  
HETATM    4  O   UNL     1      -4.856  -2.462   8.861  1.00  0.00           O  
HETATM    5  O   UNL     1      -3.150  -5.630  10.624  1.00  0.00           O  
HETATM    6  O   UNL     1      -6.255  -6.744  10.399  1.00  0.00           O  
HETATM    7  O   UNL     1      -9.194  -1.549   8.726  1.00  0.00           O  
HETATM    8  O   UNL     1      -5.020   0.589   7.883  1.00  0.00           O  
HETATM    9  O   UNL     1      -3.258   2.696   6.477  1.00  0.00           O  
HETATM   10  C   UNL     1      -3.484  -2.853   6.450  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.918  -3.391   7.755  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.444  -2.626   8.984  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.113  -3.218  10.373  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.783  -4.572  10.663  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.274  -4.565  11.025  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.058  -5.394   9.977  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.389  -4.768   9.574  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.539  -4.299   8.317  1.00  0.00           C  
HETATM   19  C   UNL     1      -8.750  -3.661   7.693  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.609  -2.144   7.817  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.676  -1.414   6.855  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.713   0.105   7.052  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.695   0.835   6.160  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.265   0.673   6.679  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.151   0.632   5.632  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.909   1.357   6.145  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.797   1.366   5.111  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.904   0.184   5.033  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.126  -0.083   3.800  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.758  -1.185   2.958  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.649  -1.280   1.624  1.00  0.00           C  
HETATM   32  C   UNL     1       0.112  -0.311   0.782  1.00  0.00           C  
HETATM   33  C   UNL     1      -1.604  -3.310  10.601  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.403  -5.043  12.472  1.00  0.00           C  
HETATM   35  C   UNL     1      -8.461  -4.697  10.628  1.00  0.00           C  
HETATM   36  C   UNL     1      -8.952  -4.124   6.252  1.00  0.00           C  
HETATM   37  C   UNL     1      -7.006   2.329   6.099  1.00  0.00           C  
HETATM   38  C   UNL     1      -3.866  -0.823   5.250  1.00  0.00           C  
HETATM   39  C   UNL     1      -1.976   2.306   4.000  1.00  0.00           C  
HETATM   40  C   UNL     1       1.335  -0.480   4.109  1.00  0.00           C  
HETATM   41  C   UNL     1      -5.362  -1.586   9.857  1.00  0.00           C  
HETATM   42  O   UNL     1      -0.512   1.383   5.714  1.00  0.00           O  
HETATM   43  H   UNL     1      -3.550  -5.024   6.924  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.799  -7.167   9.718  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.225   2.717   6.568  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.825  -3.335   7.706  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.024  -1.613   8.945  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.507  -2.533  11.137  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.611  -3.524  10.994  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.442  -5.483   9.076  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.683  -4.382   7.646  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.663  -3.939   8.230  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.663  -1.795   7.007  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.984  -1.640   5.829  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.726   0.457   6.818  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.540   0.350   8.108  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.749   0.418   5.147  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.505   1.168   4.743  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.560   0.870   7.059  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.090  -0.701   5.624  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.069   0.835   3.174  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.308  -1.950   3.501  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.134  -2.101   1.103  1.00  0.00           H  
HETATM   64  H   UNL     1       0.568   0.487   1.376  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.557   0.150   0.049  1.00  0.00           H  
HETATM   66  H   UNL     1       0.908  -0.832   0.242  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.060  -2.881   9.754  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.317  -2.765  11.505  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.295  -4.353  10.715  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.416  -5.156  12.929  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.977  -4.324  13.064  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.915  -6.009  12.513  1.00  0.00           H  
HETATM   73  H   UNL     1      -9.212  -5.455  10.426  1.00  0.00           H  
HETATM   74  H   UNL     1      -8.918  -3.711  10.608  1.00  0.00           H  
HETATM   75  H   UNL     1      -8.016  -4.869  11.604  1.00  0.00           H  
HETATM   76  H   UNL     1      -9.798  -3.601   5.796  1.00  0.00           H  
HETATM   77  H   UNL     1      -8.059  -3.920   5.654  1.00  0.00           H  
HETATM   78  H   UNL     1      -9.152  -5.199   6.218  1.00  0.00           H  
HETATM   79  H   UNL     1      -7.872   2.515   5.458  1.00  0.00           H  
HETATM   80  H   UNL     1      -7.227   2.716   7.098  1.00  0.00           H  
HETATM   81  H   UNL     1      -6.153   2.883   5.696  1.00  0.00           H  
HETATM   82  H   UNL     1      -4.795  -1.315   4.937  1.00  0.00           H  
HETATM   83  H   UNL     1      -3.149  -0.862   4.422  1.00  0.00           H  
HETATM   84  H   UNL     1      -1.021   2.763   3.725  1.00  0.00           H  
HETATM   85  H   UNL     1      -2.377   1.792   3.121  1.00  0.00           H  
HETATM   86  H   UNL     1      -2.671   3.104   4.279  1.00  0.00           H  
HETATM   87  H   UNL     1       1.539  -0.534   5.184  1.00  0.00           H  
HETATM   88  H   UNL     1       2.020   0.257   3.676  1.00  0.00           H  
HETATM   89  H   UNL     1       1.573  -1.457   3.672  1.00  0.00           H  
HETATM   90  H   UNL     1      -6.302  -1.147   9.513  1.00  0.00           H  
HETATM   91  H   UNL     1      -4.631  -0.798  10.056  1.00  0.00           H  
HETATM   92  H   UNL     1      -5.542  -2.154  10.772  1.00  0.00           H  
CONECT    1   10   38                                                 
CONECT    2   10   10                                                 
CONECT    3   11   43                                                 
CONECT    4   12   41                                                 
CONECT    5   14   14                                                 
CONECT    6   16   44                                                 
CONECT    7   20   20                                                 
CONECT    8   24   24                                                 
CONECT    9   26   45                                                 
CONECT   10    1    2    2   11                                       
CONECT   11    3   10   12   46                                       
CONECT   12    4   11   13   47                                       
CONECT   13   12   14   33   48                                       
CONECT   14    5    5   13   15                                       
CONECT   15   14   16   34   49                                       
CONECT   16    6   15   17   50                                       
CONECT   17   16   18   18   35                                       
CONECT   18   17   17   19   51                                       
CONECT   19   18   36   20   52                                       
CONECT   20    7    7   19   21                                       
CONECT   21   20   22   53   54                                       
CONECT   22   21   23   55   56                                       
CONECT   23   22   24   37   57                                       
CONECT   24    8    8   23   25                                       
CONECT   25   24   38   26   58                                       
CONECT   26    9   25   27   59                                       
CONECT   27   26   28   42   39                                       
CONECT   28   27   42   29   60                                       
CONECT   29   28   40   30   61                                       
CONECT   30   29   31   31   62                                       
CONECT   31   30   30   32   63                                       
CONECT   32   31   64   65   66                                       
CONECT   33   13   67   68   69                                       
CONECT   34   15   70   71   72                                       
CONECT   35   17   73   74   75                                       
CONECT   36   19   76   77   78                                       
CONECT   37   23   79   80   81                                       
CONECT   38    1   25   82   83                                       
CONECT   39   27   84   85   86                                       
CONECT   40   29   87   88   89                                       
CONECT   41    4   90   91   92                                       
CONECT   42   27   28                                                 
CONECT   43    3                                                      
CONECT   44    6                                                      
CONECT   45    9                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   22                                                      
CONECT   57   23                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   28                                                      
CONECT   61   29                                                      
CONECT   62   30                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   33                                                      
CONECT   69   33                                                      
CONECT   70   34                                                      
CONECT   71   34                                                      
CONECT   72   34                                                      
CONECT   73   35                                                      
CONECT   74   35                                                      
CONECT   75   35                                                      
CONECT   76   36                                                      
CONECT   77   36                                                      
CONECT   78   36                                                      
CONECT   79   37                                                      
CONECT   80   37                                                      
CONECT   81   37                                                      
CONECT   82   38                                                      
CONECT   83   38                                                      
CONECT   84   39                                                      
CONECT   85   39                                                      
CONECT   86   39                                                      
CONECT   87   40                                                      
CONECT   88   40                                                      
CONECT   89   40                                                      
CONECT   90   41                                                      
CONECT   91   41                                                      
CONECT   92   41                                                      
MASTER        0    0    0    0    0    0    0    0   92    0   92    0
END
