COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.786   1.812   0.279  1.00  0.00           C  
HETATM    2  O   UNL     1       7.557   0.408   0.140  1.00  0.00           O  
HETATM    3  C   UNL     1       6.265  -0.001   0.059  1.00  0.00           C  
HETATM    4  C   UNL     1       5.973  -1.353  -0.076  1.00  0.00           C  
HETATM    5  C   UNL     1       4.665  -1.773  -0.159  1.00  0.00           C  
HETATM    6  C   UNL     1       3.627  -0.835  -0.105  1.00  0.00           C  
HETATM    7  C   UNL     1       2.228  -1.277  -0.193  1.00  0.00           C  
HETATM    8  C   UNL     1       1.228  -0.370  -0.141  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.163  -0.810  -0.228  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.421  -1.994  -0.346  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.254   0.180  -0.171  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.962   1.544  -0.040  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.977   2.473   0.008  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.306   2.070  -0.073  1.00  0.00           C  
HETATM   15  O   UNL     1      -4.301   2.991  -0.025  1.00  0.00           O  
HETATM   16  C   UNL     1      -3.912   4.359   0.109  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.613   0.714  -0.204  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.012   0.244  -0.294  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.252  -1.049  -0.085  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.117  -1.982   0.245  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.462  -3.389  -0.248  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.915  -2.014   1.761  1.00  0.00           C  
HETATM   23  O   UNL     1      -2.911  -1.545  -0.382  1.00  0.00           O  
HETATM   24  C   UNL     1      -2.587  -0.236  -0.254  1.00  0.00           C  
HETATM   25  C   UNL     1       3.926   0.526   0.032  1.00  0.00           C  
HETATM   26  C   UNL     1       5.238   0.935   0.118  1.00  0.00           C  
HETATM   27  H   UNL     1       7.367   2.335  -0.581  1.00  0.00           H  
HETATM   28  H   UNL     1       7.308   2.170   1.191  1.00  0.00           H  
HETATM   29  H   UNL     1       8.858   2.001   0.332  1.00  0.00           H  
HETATM   30  H   UNL     1       6.775  -2.076  -0.117  1.00  0.00           H  
HETATM   31  H   UNL     1       4.440  -2.824  -0.265  1.00  0.00           H  
HETATM   32  H   UNL     1       2.000  -2.327  -0.298  1.00  0.00           H  
HETATM   33  H   UNL     1       1.457   0.681  -0.035  1.00  0.00           H  
HETATM   34  H   UNL     1       0.066   1.868   0.024  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.740   3.521   0.110  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.349   4.488   1.034  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.289   4.645  -0.738  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.801   4.989   0.135  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.815   0.930  -0.522  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.261  -1.428  -0.152  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.616  -3.369  -1.326  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.642  -4.067  -0.010  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.372  -3.733   0.243  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.828  -2.365   2.242  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.094  -2.689   2.004  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.679  -1.011   2.118  1.00  0.00           H  
HETATM   47  H   UNL     1       3.129   1.254   0.073  1.00  0.00           H  
HETATM   48  H   UNL     1       5.470   1.984   0.224  1.00  0.00           H  
CONECT    1    2   27   28   29                                       
CONECT    2    3    1                                                 
CONECT    3   26   26    4    2                                       
CONECT    4    5    5    3   30                                       
CONECT    5    6    4    4   31                                       
CONECT    6    7   25   25    5                                       
CONECT    7    8    8    6   32                                       
CONECT    8    9    7    7   33                                       
CONECT    9   11   10   10    8                                       
CONECT   10    9    9                                                 
CONECT   11   12   12   24    9                                       
CONECT   12   13   11   11   34                                       
CONECT   13   14   14   12   35                                       
CONECT   14   15   13   13   17                                       
CONECT   15   16   14                                                 
CONECT   16   15   36   37   38                                       
CONECT   17   14   18   24   24                                       
CONECT   18   17   19   19   39                                       
CONECT   19   18   18   20   40                                       
CONECT   20   19   22   23   21                                       
CONECT   21   20   41   42   43                                       
CONECT   22   20   44   45   46                                       
CONECT   23   24   20                                                 
CONECT   24   17   17   11   23                                       
CONECT   25    6    6   26   47                                       
CONECT   26   25    3    3   48                                       
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   21                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
