COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      11.360   5.629  -0.900  1.00  0.00           C  
HETATM    2  C   UNL     1      11.388   6.291   0.313  1.00  0.00           C  
HETATM    3  C   UNL     1      11.117   5.604   1.482  1.00  0.00           C  
HETATM    4  C   UNL     1      10.817   4.255   1.437  1.00  0.00           C  
HETATM    5  C   UNL     1      10.789   3.593   0.224  1.00  0.00           C  
HETATM    6  C   UNL     1      11.061   4.280  -0.944  1.00  0.00           C  
HETATM    7  C   UNL     1      10.463   2.123   0.176  1.00  0.00           C  
HETATM    8  C   UNL     1       8.588   0.676  -0.030  1.00  0.00           C  
HETATM    9  C   UNL     1       9.475  -0.389   0.049  1.00  0.00           C  
HETATM   10  C   UNL     1       9.010  -1.691  -0.006  1.00  0.00           C  
HETATM   11  C   UNL     1       7.660  -1.940  -0.140  1.00  0.00           C  
HETATM   12  C   UNL     1       6.758  -0.875  -0.220  1.00  0.00           C  
HETATM   13  C   UNL     1       7.231   0.439  -0.164  1.00  0.00           C  
HETATM   14  C   UNL     1       5.316  -1.136  -0.364  1.00  0.00           C  
HETATM   15  C   UNL     1       4.810  -2.554  -0.425  1.00  0.00           C  
HETATM   16  C   UNL     1       3.310  -2.546  -0.572  1.00  0.00           C  
HETATM   17  C   UNL     1       2.563  -3.833  -0.656  1.00  0.00           C  
HETATM   18  C   UNL     1       0.467  -2.568  -0.608  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.468  -2.567   0.608  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.468  -5.097   0.609  1.00  0.00           C  
HETATM   21  C   UNL     1       0.467  -5.098  -0.607  1.00  0.00           C  
HETATM   22  N   UNL     1       1.215  -3.833  -0.625  1.00  0.00           N  
HETATM   23  N   UNL     1      -1.215  -3.832   0.626  1.00  0.00           N  
HETATM   24  O   UNL     1       9.052   1.952   0.031  1.00  0.00           O  
HETATM   25  O   UNL     1       4.536  -0.210  -0.433  1.00  0.00           O  
HETATM   26  O   UNL     1       2.714  -1.497  -0.622  1.00  0.00           O  
HETATM   27  O   UNL     1       3.167  -4.881  -0.753  1.00  0.00           O  
HETATM   28  C   UNL     1      -2.563  -3.832   0.658  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.310  -2.545   0.572  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.810  -2.553   0.425  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.316  -1.135   0.362  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.231   0.440   0.159  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.758  -0.874   0.218  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.660  -1.940   0.139  1.00  0.00           C  
HETATM   35  C   UNL     1      -9.010  -1.691   0.003  1.00  0.00           C  
HETATM   36  C   UNL     1      -9.475  -0.389  -0.055  1.00  0.00           C  
HETATM   37  C   UNL     1      -8.587   0.676   0.022  1.00  0.00           C  
HETATM   38  C   UNL     1     -10.464   2.123  -0.177  1.00  0.00           C  
HETATM   39  C   UNL     1     -10.821   4.258  -1.434  1.00  0.00           C  
HETATM   40  C   UNL     1     -10.790   3.593  -0.222  1.00  0.00           C  
HETATM   41  C   UNL     1     -11.058   4.278   0.948  1.00  0.00           C  
HETATM   42  C   UNL     1     -11.357   5.627   0.907  1.00  0.00           C  
HETATM   43  C   UNL     1     -11.387   6.292  -0.305  1.00  0.00           C  
HETATM   44  C   UNL     1     -11.118   5.607  -1.475  1.00  0.00           C  
HETATM   45  O   UNL     1      -3.167  -4.880   0.756  1.00  0.00           O  
HETATM   46  O   UNL     1      -2.714  -1.496   0.621  1.00  0.00           O  
HETATM   47  O   UNL     1      -4.536  -0.210   0.430  1.00  0.00           O  
HETATM   48  O   UNL     1      -9.052   1.952  -0.035  1.00  0.00           O  
HETATM   49  H   UNL     1      11.568   6.166  -1.813  1.00  0.00           H  
HETATM   50  H   UNL     1      11.622   7.345   0.348  1.00  0.00           H  
HETATM   51  H   UNL     1      11.139   6.122   2.430  1.00  0.00           H  
HETATM   52  H   UNL     1      10.606   3.719   2.350  1.00  0.00           H  
HETATM   53  H   UNL     1      11.039   3.763  -1.892  1.00  0.00           H  
HETATM   54  H   UNL     1      10.973   1.666  -0.672  1.00  0.00           H  
HETATM   55  H   UNL     1      10.794   1.647   1.099  1.00  0.00           H  
HETATM   56  H   UNL     1      10.533  -0.201   0.154  1.00  0.00           H  
HETATM   57  H   UNL     1       9.706  -2.514   0.055  1.00  0.00           H  
HETATM   58  H   UNL     1       7.300  -2.958  -0.184  1.00  0.00           H  
HETATM   59  H   UNL     1       6.540   1.267  -0.225  1.00  0.00           H  
HETATM   60  H   UNL     1       5.256  -3.062  -1.280  1.00  0.00           H  
HETATM   61  H   UNL     1       5.082  -3.077   0.491  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.120  -2.479  -1.522  1.00  0.00           H  
HETATM   63  H   UNL     1       1.164  -1.733  -0.535  1.00  0.00           H  
HETATM   64  H   UNL     1       0.120  -2.477   1.521  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.164  -1.732   0.533  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.164  -5.933   0.536  1.00  0.00           H  
HETATM   67  H   UNL     1       0.120  -5.187   1.523  1.00  0.00           H  
HETATM   68  H   UNL     1       1.164  -5.934  -0.532  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.120  -5.189  -1.520  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.082  -3.078  -0.491  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.256  -3.061   1.280  1.00  0.00           H  
HETATM   72  H   UNL     1      -6.540   1.267   0.224  1.00  0.00           H  
HETATM   73  H   UNL     1      -7.300  -2.957   0.183  1.00  0.00           H  
HETATM   74  H   UNL     1      -9.706  -2.514  -0.058  1.00  0.00           H  
HETATM   75  H   UNL     1     -10.533  -0.201  -0.161  1.00  0.00           H  
HETATM   76  H   UNL     1     -10.972   1.664   0.671  1.00  0.00           H  
HETATM   77  H   UNL     1     -10.796   1.648  -1.100  1.00  0.00           H  
HETATM   78  H   UNL     1     -10.607   3.724  -2.348  1.00  0.00           H  
HETATM   79  H   UNL     1     -11.034   3.759   1.895  1.00  0.00           H  
HETATM   80  H   UNL     1     -11.567   6.162   1.821  1.00  0.00           H  
HETATM   81  H   UNL     1     -11.622   7.345  -0.337  1.00  0.00           H  
HETATM   82  H   UNL     1     -11.143   6.126  -2.422  1.00  0.00           H  
CONECT    1    2    2    6   49                                       
CONECT    2    1    1    3   50                                       
CONECT    3    2    4    4   51                                       
CONECT    4    3    3    5   52                                       
CONECT    5    4    6    6    7                                       
CONECT    6    1    5    5   53                                       
CONECT    7    5   24   54   55                                       
CONECT    8    9    9   13   24                                       
CONECT    9    8    8   10   56                                       
CONECT   10    9   11   11   57                                       
CONECT   11   10   10   12   58                                       
CONECT   12   11   13   13   14                                       
CONECT   13    8   12   12   59                                       
CONECT   14   12   15   25   25                                       
CONECT   15   14   16   60   61                                       
CONECT   16   15   17   26   26                                       
CONECT   17   16   22   27   27                                       
CONECT   18   19   22   62   63                                       
CONECT   19   18   23   64   65                                       
CONECT   20   21   23   66   67                                       
CONECT   21   20   22   68   69                                       
CONECT   22   17   18   21                                            
CONECT   23   19   20   28                                            
CONECT   24    7    8                                                 
CONECT   25   14   14                                                 
CONECT   26   16   16                                                 
CONECT   27   17   17                                                 
CONECT   28   23   29   45   45                                       
CONECT   29   28   30   46   46                                       
CONECT   30   29   31   70   71                                       
CONECT   31   30   33   47   47                                       
CONECT   32   33   33   37   72                                       
CONECT   33   31   32   32   34                                       
CONECT   34   33   35   35   73                                       
CONECT   35   34   34   36   74                                       
CONECT   36   35   37   37   75                                       
CONECT   37   32   36   36   48                                       
CONECT   38   40   48   76   77                                       
CONECT   39   40   40   44   78                                       
CONECT   40   38   39   39   41                                       
CONECT   41   40   42   42   79                                       
CONECT   42   41   41   43   80                                       
CONECT   43   42   44   44   81                                       
CONECT   44   39   43   43   82                                       
CONECT   45   28   28                                                 
CONECT   46   29   29                                                 
CONECT   47   31   31                                                 
CONECT   48   37   38                                                 
CONECT   49    1                                                      
CONECT   50    2                                                      
CONECT   51    3                                                      
CONECT   52    4                                                      
CONECT   53    6                                                      
CONECT   54    7                                                      
CONECT   55    7                                                      
CONECT   56    9                                                      
CONECT   57   10                                                      
CONECT   58   11                                                      
CONECT   59   13                                                      
CONECT   60   15                                                      
CONECT   61   15                                                      
CONECT   62   18                                                      
CONECT   63   18                                                      
CONECT   64   19                                                      
CONECT   65   19                                                      
CONECT   66   20                                                      
CONECT   67   20                                                      
CONECT   68   21                                                      
CONECT   69   21                                                      
CONECT   70   30                                                      
CONECT   71   30                                                      
CONECT   72   32                                                      
CONECT   73   34                                                      
CONECT   74   35                                                      
CONECT   75   36                                                      
CONECT   76   38                                                      
CONECT   77   38                                                      
CONECT   78   39                                                      
CONECT   79   41                                                      
CONECT   80   42                                                      
CONECT   81   43                                                      
CONECT   82   44                                                      
MASTER        0    0    0    0    0    0    0    0   82    0   82    0
END
