COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.157  -2.027  -0.050  1.00  0.00           C  
HETATM    2  N   UNL     1      -3.072  -3.480  -0.462  1.00  0.00           N1+
HETATM    3  O   UNL     1       0.409  -4.010   0.419  1.00  0.00           O  
HETATM    4  C   UNL     1       5.777  -2.176   0.079  1.00  0.00           C  
HETATM    5  N   UNL     1       3.866  -3.557  -0.505  1.00  0.00           N1+
HETATM    6  O   UNL     1      -0.400   3.973   0.379  1.00  0.00           O  
HETATM    7  C   UNL     1       7.726  -0.793  -0.119  1.00  0.00           C  
HETATM    8  N   UNL     1      -3.893   3.572  -0.530  1.00  0.00           N1+
HETATM    9  C   UNL     1       6.913   0.352  -0.060  1.00  0.00           C  
HETATM   10  N   UNL     1       3.057   3.472  -0.423  1.00  0.00           N1+
HETATM   11  C   UNL     1       5.510   0.201   0.071  1.00  0.00           C  
HETATM   12  C   UNL     1       4.958  -1.090   0.140  1.00  0.00           C  
HETATM   13  C   UNL     1       7.463   1.643  -0.129  1.00  0.00           C  
HETATM   14  C   UNL     1       6.643   2.728  -0.071  1.00  0.00           C  
HETATM   15  C   UNL     1       5.263   2.580   0.056  1.00  0.00           C  
HETATM   16  C   UNL     1       4.695   1.345   0.127  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.384  -3.800   0.115  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.962   1.091   0.151  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.781   2.177   0.095  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.161   2.028  -0.030  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.730   0.793  -0.101  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.916  -0.351  -0.047  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.513  -0.200   0.080  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.466  -1.643  -0.119  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.645  -2.727  -0.067  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.265  -2.578   0.059  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.698  -1.343   0.133  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.010  -4.007   0.405  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.734  -4.205  -0.416  1.00  0.00           C  
HETATM   30  C   UNL     1       1.630  -4.490  -0.149  1.00  0.00           C  
HETATM   31  C   UNL     1       2.814  -3.770   0.498  1.00  0.00           C  
HETATM   32  C   UNL     1       5.180  -3.557   0.152  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.184   3.558   0.171  1.00  0.00           C  
HETATM   34  C   UNL     1      -2.805   3.720   0.445  1.00  0.00           C  
HETATM   35  C   UNL     1      -1.618   4.422  -0.219  1.00  0.00           C  
HETATM   36  C   UNL     1       0.774   4.352  -0.343  1.00  0.00           C  
HETATM   37  C   UNL     1       2.017   3.993   0.473  1.00  0.00           C  
HETATM   38  C   UNL     1       4.383   3.802   0.116  1.00  0.00           C  
HETATM   39  H   UNL     1       7.784  -2.905  -0.091  1.00  0.00           H  
HETATM   40  H   UNL     1       3.832  -4.298  -1.189  1.00  0.00           H  
HETATM   41  H   UNL     1       3.719  -2.670  -0.962  1.00  0.00           H  
HETATM   42  H   UNL     1       8.797  -0.694  -0.218  1.00  0.00           H  
HETATM   43  H   UNL     1       3.891  -1.219   0.241  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.996  -3.897  -1.377  1.00  0.00           H  
HETATM   45  H   UNL     1       8.531   1.775  -0.228  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.975  -2.478  -0.541  1.00  0.00           H  
HETATM   47  H   UNL     1       7.068   3.720  -0.124  1.00  0.00           H  
HETATM   48  H   UNL     1       3.625   1.244   0.227  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.845  -4.607  -0.454  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.259  -4.111   1.152  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.894   1.221   0.248  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.789   2.905  -0.071  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.801   0.694  -0.197  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.534  -1.774  -0.215  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.069  -3.719  -0.122  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.627  -1.242   0.230  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.816  -3.301   1.213  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.324  -4.963   0.825  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.713  -3.485  -1.234  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.718  -5.216  -0.823  1.00  0.00           H  
HETATM   61  H   UNL     1       1.716  -5.562   0.028  1.00  0.00           H  
HETATM   62  H   UNL     1       1.631  -4.299  -1.222  1.00  0.00           H  
HETATM   63  H   UNL     1       3.208  -4.378   1.313  1.00  0.00           H  
HETATM   64  H   UNL     1       2.485  -2.808   0.889  1.00  0.00           H  
HETATM   65  H   UNL     1       5.838  -4.265  -0.352  1.00  0.00           H  
HETATM   66  H   UNL     1       5.064  -3.849   1.196  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.033   3.832   1.215  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.860   4.273  -0.298  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.152   4.314   1.290  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.495   2.735   0.795  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.776   2.707  -1.036  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.713   5.499  -0.084  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.608   4.189  -1.283  1.00  0.00           H  
HETATM   74  H   UNL     1      -3.871   4.345  -1.179  1.00  0.00           H  
HETATM   75  H   UNL     1       0.800   3.822  -1.296  1.00  0.00           H  
HETATM   76  H   UNL     1       0.756   5.426  -0.526  1.00  0.00           H  
HETATM   77  H   UNL     1       1.760   3.234   1.212  1.00  0.00           H  
HETATM   78  H   UNL     1       2.387   4.884   0.981  1.00  0.00           H  
HETATM   79  H   UNL     1       4.829   4.600  -0.478  1.00  0.00           H  
HETATM   80  H   UNL     1       4.285   4.129   1.151  1.00  0.00           H  
HETATM   81  H   UNL     1       2.964   2.470  -0.499  1.00  0.00           H  
HETATM   82  H   UNL     1       2.953   3.889  -1.337  1.00  0.00           H  
CONECT    1    4    4    7   39                                       
CONECT    2   17   28   44   46                                       
CONECT    3   29   30                                                 
CONECT    4    1    1   12   32                                       
CONECT    5   31   32   40   41                                       
CONECT    6   35   36                                                 
CONECT    7    1    9    9   42                                       
CONECT    8   33   34   71   74                                       
CONECT    9    7    7   11   13                                       
CONECT   10   37   38   81   82                                       
CONECT   11    9   12   12   16                                       
CONECT   12    4   11   11   43                                       
CONECT   13    9   14   14   45                                       
CONECT   14   13   13   15   47                                       
CONECT   15   14   16   16   38                                       
CONECT   16   11   15   15   48                                       
CONECT   17    2   26   49   50                                       
CONECT   18   19   19   23   51                                       
CONECT   19   18   18   20   33                                       
CONECT   20   19   21   21   52                                       
CONECT   21   20   20   22   53                                       
CONECT   22   21   23   23   24                                       
CONECT   23   18   22   22   27                                       
CONECT   24   22   25   25   54                                       
CONECT   25   24   24   26   55                                       
CONECT   26   17   25   27   27                                       
CONECT   27   23   26   26   56                                       
CONECT   28    2   29   57   58                                       
CONECT   29    3   28   59   60                                       
CONECT   30    3   31   61   62                                       
CONECT   31    5   30   63   64                                       
CONECT   32    4    5   65   66                                       
CONECT   33    8   19   67   68                                       
CONECT   34    8   35   69   70                                       
CONECT   35    6   34   72   73                                       
CONECT   36    6   37   75   76                                       
CONECT   37   10   36   77   78                                       
CONECT   38   10   15   79   80                                       
CONECT   39    1                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    7                                                      
CONECT   43   12                                                      
CONECT   44    2                                                      
CONECT   45   13                                                      
CONECT   46    2                                                      
CONECT   47   14                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   30                                                      
CONECT   63   31                                                      
CONECT   64   31                                                      
CONECT   65   32                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   33                                                      
CONECT   69   34                                                      
CONECT   70   34                                                      
CONECT   71    8                                                      
CONECT   72   35                                                      
CONECT   73   35                                                      
CONECT   74    8                                                      
CONECT   75   36                                                      
CONECT   76   36                                                      
CONECT   77   37                                                      
CONECT   78   37                                                      
CONECT   79   38                                                      
CONECT   80   38                                                      
CONECT   81   10                                                      
CONECT   82   10                                                      
MASTER        0    0    0    0    0    0    0    0   82    0   82    0
END
