COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.969  -3.303  14.540  1.00  0.00           C  
HETATM    2  C   UNL     1       1.829  -3.151  14.189  1.00  0.00           C  
HETATM    3  C   UNL     1       1.640   1.125  11.947  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.180   1.068  12.496  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.588  -2.939  14.256  1.00  0.00           N  
HETATM    6  C   UNL     1      -1.665  -3.694  14.671  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.157  -4.909  15.245  1.00  0.00           C  
HETATM    8  C   UNL     1       0.219  -4.850  15.163  1.00  0.00           C  
HETATM    9  C   UNL     1       0.567  -3.623  14.520  1.00  0.00           C  
HETATM   10  C   UNL     1       1.222  -5.860  15.658  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.002  -5.989  15.868  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.115  -5.768  17.376  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.862  -6.863  18.119  1.00  0.00           C  
HETATM   14  O   UNL     1      -3.265  -6.600  19.273  1.00  0.00           O  
HETATM   15  O   UNL     1      -3.034  -7.987  17.545  1.00  0.00           O  
HETATM   16  N   UNL     1       1.318  -1.002  13.126  1.00  0.00           N  
HETATM   17  C   UNL     1       2.174  -1.988  13.555  1.00  0.00           C  
HETATM   18  C   UNL     1       3.553  -1.639  13.251  1.00  0.00           C  
HETATM   19  C   UNL     1       3.459  -0.415  12.614  1.00  0.00           C  
HETATM   20  C   UNL     1       2.120  -0.046  12.542  1.00  0.00           C  
HETATM   21  C   UNL     1       4.793  -2.460  13.541  1.00  0.00           C  
HETATM   22  C   UNL     1       4.489   0.438  12.108  1.00  0.00           C  
HETATM   23  C   UNL     1       5.612   0.094  11.545  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.750   0.791  12.356  1.00  0.00           N  
HETATM   25  C   UNL     1       0.318   1.526  11.871  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.204   2.726  11.283  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.594   2.667  11.407  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.912   1.492  12.134  1.00  0.00           C  
HETATM   29  C   UNL     1       0.629   3.795  10.618  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.629   3.631  11.018  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.412   4.868  10.718  1.00  0.00           C  
HETATM   32  N   UNL     1      -2.654  -1.112  13.491  1.00  0.00           N  
HETATM   33  C   UNL     1      -3.516  -0.100  13.167  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.881  -0.446  13.548  1.00  0.00           C  
HETATM   35  C   UNL     1      -4.855  -1.730  13.988  1.00  0.00           C  
HETATM   36  C   UNL     1      -3.446  -2.117  13.991  1.00  0.00           C  
HETATM   37  C   UNL     1      -6.084   0.452  13.463  1.00  0.00           C  
HETATM   38  C   UNL     1      -6.028  -2.575  14.424  1.00  0.00           C  
HETATM   39  C   UNL     1      -6.583  -3.340  13.222  1.00  0.00           C  
HETATM   40  C   UNL     1      -7.823  -4.164  13.566  1.00  0.00           C  
HETATM   41  O   UNL     1      -8.849  -4.015  12.870  1.00  0.00           O  
HETATM   42  O   UNL     1      -7.757  -4.936  14.542  1.00  0.00           O  
HETATM   43 CR   UNL     1      -0.702  -1.059  13.299  1.00  0.00          Cr  
HETATM   44  H   UNL     1      -3.714  -3.994  14.905  1.00  0.00           H  
HETATM   45  H   UNL     1       2.653  -3.790  14.471  1.00  0.00           H  
HETATM   46  H   UNL     1       2.374   1.781  11.503  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.999   1.719  12.226  1.00  0.00           H  
HETATM   48  H   UNL     1       0.693  -6.711  16.112  1.00  0.00           H  
HETATM   49  H   UNL     1       1.832  -6.215  14.814  1.00  0.00           H  
HETATM   50  H   UNL     1       1.874  -5.391  16.410  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.007  -5.967  15.421  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.538  -6.968  15.678  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.098  -5.703  17.791  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.641  -4.817  17.545  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.707  -7.359  19.635  1.00  0.00           H  
HETATM   56  H   UNL     1       5.190  -2.188  14.530  1.00  0.00           H  
HETATM   57  H   UNL     1       4.535  -3.529  13.531  1.00  0.00           H  
HETATM   58  H   UNL     1       5.554  -2.259  12.772  1.00  0.00           H  
HETATM   59  H   UNL     1       4.314   1.499  12.205  1.00  0.00           H  
HETATM   60  H   UNL     1       6.302   0.853  11.208  1.00  0.00           H  
HETATM   61  H   UNL     1       5.853  -0.951  11.415  1.00  0.00           H  
HETATM   62  H   UNL     1       1.694   3.533  10.698  1.00  0.00           H  
HETATM   63  H   UNL     1       0.349   3.871   9.557  1.00  0.00           H  
HETATM   64  H   UNL     1       0.450   4.760  11.114  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.650   3.280  10.980  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.236   5.509  10.442  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.407   5.261  10.743  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.972  -0.089  13.821  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.921   1.343  14.087  1.00  0.00           H  
HETATM   70  H   UNL     1      -6.239   0.759  12.418  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.813  -1.926  14.839  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.699  -3.290  15.193  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.803  -4.019  12.847  1.00  0.00           H  
HETATM   74  H   UNL     1      -6.848  -2.617  12.437  1.00  0.00           H  
HETATM   75  H   UNL     1      -8.592  -5.373  14.658  1.00  0.00           H  
CONECT    1   36   36    6   44                                       
CONECT    2   17    9    9   45                                       
CONECT    3   25   25   20   46                                       
CONECT    4   28   33   33   47                                       
CONECT    5   43    9    6    6                                       
CONECT    6    5    5    1    7                                       
CONECT    7    6    8    8   11                                       
CONECT    8    9    7    7   10                                       
CONECT    9    2    2    5    8                                       
CONECT   10    8   48   49   50                                       
CONECT   11    7   12   51   52                                       
CONECT   12   11   13   53   54                                       
CONECT   13   12   15   15   14                                       
CONECT   14   13   55                                                 
CONECT   15   13   13                                                 
CONECT   16   20   43   17                                            
CONECT   17   16   18   18    2                                       
CONECT   18   19   21   17   17                                       
CONECT   19   22   20   20   18                                       
CONECT   20    3   19   19   16                                       
CONECT   21   18   56   57   58                                       
CONECT   22   23   23   19   59                                       
CONECT   23   22   22   60   61                                       
CONECT   24   25   28   28   43                                       
CONECT   25   26    3    3   24                                       
CONECT   26   29   27   27   25                                       
CONECT   27   30   26   26   28                                       
CONECT   28   27   24   24    4                                       
CONECT   29   26   62   63   64                                       
CONECT   30   31   31   27   65                                       
CONECT   31   30   30   66   67                                       
CONECT   32   33   43   36                                            
CONECT   33    4    4   32   34                                       
CONECT   34   33   37   35   35                                       
CONECT   35   34   34   36   38                                       
CONECT   36   32   35    1    1                                       
CONECT   37   34   68   69   70                                       
CONECT   38   39   35   71   72                                       
CONECT   39   40   38   73   74                                       
CONECT   40   41   41   39   42                                       
CONECT   41   40   40                                                 
CONECT   42   40   75                                                 
CONECT   43   24   16   32    5                                       
CONECT   44    1                                                      
CONECT   45    2                                                      
CONECT   46    3                                                      
CONECT   47    4                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   12                                                      
CONECT   55   14                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   23                                                      
CONECT   62   29                                                      
CONECT   63   29                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   31                                                      
CONECT   68   37                                                      
CONECT   69   37                                                      
CONECT   70   37                                                      
CONECT   71   38                                                      
CONECT   72   38                                                      
CONECT   73   39                                                      
CONECT   74   39                                                      
CONECT   75   42                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
