COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.029   3.416  -0.104  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.443   3.359  -0.279  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.258   2.823   0.743  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.611   2.780   0.561  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.163   3.272  -0.644  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.015   3.828  -1.425  1.00  0.00           C  
HETATM    7  C   UNL     1       1.792   2.257  -0.221  1.00  0.00           C  
HETATM    8  C   UNL     1       5.093   1.042   0.512  1.00  0.00           C  
HETATM    9  C   UNL     1       5.948  -0.149   0.326  1.00  0.00           C  
HETATM   10  C   UNL     1       7.145  -0.270   1.034  1.00  0.00           C  
HETATM   11  C   UNL     1       7.938  -1.385   0.856  1.00  0.00           C  
HETATM   12  C   UNL     1       7.550  -2.381  -0.022  1.00  0.00           C  
HETATM   13  C   UNL     1       6.365  -2.266  -0.727  1.00  0.00           C  
HETATM   14  C   UNL     1       1.125   0.941  -0.526  1.00  0.00           C  
HETATM   15  C   UNL     1       5.559  -1.160  -0.554  1.00  0.00           C  
HETATM   16  C   UNL     1       8.422  -3.595  -0.212  1.00  0.00           C  
HETATM   17  C   UNL     1       9.796  -3.161  -0.726  1.00  0.00           C  
HETATM   18  C   UNL     1       8.583  -4.321   1.125  1.00  0.00           C  
HETATM   19  C   UNL     1       3.167   2.318  -0.056  1.00  0.00           C  
HETATM   20  C   UNL     1       7.771  -4.536  -1.228  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.279   1.188   1.269  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.923  -0.270   1.971  1.00  0.00           C  
HETATM   23  C   UNL     1       3.780   3.533   0.225  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.940  -0.898   0.724  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.070  -0.444  -0.279  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.242   0.608   0.002  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.948   4.287  -2.841  1.00  0.00           C  
HETATM   28  C   UNL     1       3.022   4.683   0.342  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.859  -2.023   0.465  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.525  -4.569  -0.360  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.052  -3.178  -0.730  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.380  -4.148  -0.647  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.740  -5.492  -0.281  1.00  0.00           C  
HETATM   34  C   UNL     1       1.653   4.632   0.173  1.00  0.00           C  
HETATM   35  N   UNL     1      -2.360   3.776  -1.600  1.00  0.00           N  
HETATM   36  N   UNL     1       3.938   1.156  -0.173  1.00  0.00           N  
HETATM   37  N   UNL     1      -3.443   2.254   1.557  1.00  0.00           N  
HETATM   38  N   UNL     1      -5.107   0.737   2.201  1.00  0.00           N  
HETATM   39  N   UNL     1      -6.447  -3.073  -0.273  1.00  0.00           N  
HETATM   40  O   UNL     1      -4.370   3.239  -0.818  1.00  0.00           O  
HETATM   41  O   UNL     1       5.431   1.919   1.283  1.00  0.00           O  
HETATM   42  O   UNL     1      -7.987  -2.004   0.919  1.00  0.00           O  
HETATM   43  O   UNL     1      -5.430  -5.561  -0.851  1.00  0.00           O  
HETATM   44  H   UNL     1      -0.817   2.452   1.656  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.390   4.237  -2.205  1.00  0.00           H  
HETATM   46  H   UNL     1       7.449   0.507   1.720  1.00  0.00           H  
HETATM   47  H   UNL     1       8.864  -1.480   1.404  1.00  0.00           H  
HETATM   48  H   UNL     1       6.068  -3.047  -1.412  1.00  0.00           H  
HETATM   49  H   UNL     1       1.077   0.800  -1.606  1.00  0.00           H  
HETATM   50  H   UNL     1       1.699   0.130  -0.079  1.00  0.00           H  
HETATM   51  H   UNL     1       0.115   0.941  -0.115  1.00  0.00           H  
HETATM   52  H   UNL     1       4.635  -1.072  -1.105  1.00  0.00           H  
HETATM   53  H   UNL     1      10.427  -4.040  -0.863  1.00  0.00           H  
HETATM   54  H   UNL     1       9.681  -2.644  -1.678  1.00  0.00           H  
HETATM   55  H   UNL     1      10.259  -2.491  -0.002  1.00  0.00           H  
HETATM   56  H   UNL     1       7.604  -4.630   1.492  1.00  0.00           H  
HETATM   57  H   UNL     1       9.214  -5.199   0.988  1.00  0.00           H  
HETATM   58  H   UNL     1       9.047  -3.651   1.849  1.00  0.00           H  
HETATM   59  H   UNL     1       6.792  -4.845  -0.862  1.00  0.00           H  
HETATM   60  H   UNL     1       7.656  -4.019  -2.180  1.00  0.00           H  
HETATM   61  H   UNL     1       8.402  -5.415  -1.365  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.589  -0.610   2.751  1.00  0.00           H  
HETATM   63  H   UNL     1       4.852   3.580   0.353  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.060  -0.910  -1.254  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.566   0.987  -0.752  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.002   3.483  -3.575  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.951   4.664  -2.639  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.328   5.094  -3.231  1.00  0.00           H  
HETATM   69  H   UNL     1       3.503   5.625   0.560  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.543  -4.717  -0.809  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.446  -4.652   0.724  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.448  -2.414  -0.241  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.009  -3.044  -1.811  1.00  0.00           H  
HETATM   74  H   UNL     1      -7.571  -4.113  -1.719  1.00  0.00           H  
HETATM   75  H   UNL     1      -8.317  -4.028  -0.103  1.00  0.00           H  
HETATM   76  H   UNL     1      -6.669  -5.579   0.803  1.00  0.00           H  
HETATM   77  H   UNL     1      -7.351  -6.305  -0.672  1.00  0.00           H  
HETATM   78  H   UNL     1       1.064   5.533   0.261  1.00  0.00           H  
HETATM   79  H   UNL     1       3.641   0.433  -0.747  1.00  0.00           H  
HETATM   80  H   UNL     1      -3.433   2.636   2.448  1.00  0.00           H  
CONECT    1    7    2   34   34                                       
CONECT    2    6    6    1    3                                       
CONECT    3    2    4    4   44                                       
CONECT    4    5    3    3   37                                       
CONECT    5   35   40   40    4                                       
CONECT    6   35    2    2   45                                       
CONECT    7   14   19   19    1                                       
CONECT    8    9   41   41   36                                       
CONECT    9   10   10   15    8                                       
CONECT   10   11    9    9   46                                       
CONECT   11   12   12   10   47                                       
CONECT   12   16   11   11   13                                       
CONECT   13   12   15   15   48                                       
CONECT   14    7   49   50   51                                       
CONECT   15   13   13    9   52                                       
CONECT   16   17   20   18   12                                       
CONECT   17   16   53   54   55                                       
CONECT   18   16   56   57   58                                       
CONECT   19   36    7    7   23                                       
CONECT   20   16   59   60   61                                       
CONECT   21   37   38   38   26                                       
CONECT   22   38   24   24   62                                       
CONECT   23   19   28   28   63                                       
CONECT   24   22   22   25   29                                       
CONECT   25   26   26   24   64                                       
CONECT   26   21   25   25   65                                       
CONECT   27   35   66   67   68                                       
CONECT   28   23   23   34   69                                       
CONECT   29   24   42   42   39                                       
CONECT   30   31   43   70   71                                       
CONECT   31   39   30   72   73                                       
CONECT   32   39   33   74   75                                       
CONECT   33   32   43   76   77                                       
CONECT   34    1    1   28   78                                       
CONECT   35   27    6    5                                            
CONECT   36    8   19   79                                            
CONECT   37    4   21   80                                            
CONECT   38   21   21   22                                            
CONECT   39   29   31   32                                            
CONECT   40    5    5                                                 
CONECT   41    8    8                                                 
CONECT   42   29   29                                                 
CONECT   43   30   33                                                 
CONECT   44    3                                                      
CONECT   45    6                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   18                                                      
CONECT   59   20                                                      
CONECT   60   20                                                      
CONECT   61   20                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   25                                                      
CONECT   65   26                                                      
CONECT   66   27                                                      
CONECT   67   27                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   30                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   31                                                      
CONECT   74   32                                                      
CONECT   75   32                                                      
CONECT   76   33                                                      
CONECT   77   33                                                      
CONECT   78   34                                                      
CONECT   79   36                                                      
CONECT   80   37                                                      
MASTER        0    0    0    0    0    0    0    0   80    0   80    0
END
