COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.377   0.078  -0.163  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.817   0.457   1.190  1.00  0.00           C  
HETATM    3  C   UNL     1       0.558  -0.207   1.321  1.00  0.00           C  
HETATM    4  C   UNL     1       1.503   0.369   0.271  1.00  0.00           C  
HETATM    5  C   UNL     1       2.143   0.185  -4.592  1.00  0.00           C  
HETATM    6  C   UNL     1       1.644   0.093  -5.857  1.00  0.00           C  
HETATM    7  C   UNL     1       0.277  -0.023  -6.083  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.609  -0.050  -5.028  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.991   0.013  -2.606  1.00  0.00           C  
HETATM   10  C   UNL     1       1.769   0.263  -2.176  1.00  0.00           C  
HETATM   11  C   UNL     1       1.274   0.163  -3.490  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.120   0.041  -3.710  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.465   0.112  -1.315  1.00  0.00           C  
HETATM   14  C   UNL     1       0.923   0.243  -1.112  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.239  -0.120  -7.495  1.00  0.00           C  
HETATM   16  O   UNL     1      -2.540  -0.243  -0.293  1.00  0.00           O  
HETATM   17  O   UNL     1      -1.942  -0.165  -5.257  1.00  0.00           O  
HETATM   18  O   UNL     1      -2.326  -0.107  -2.792  1.00  0.00           O  
HETATM   19  C   UNL     1       1.124   0.058   2.718  1.00  0.00           C  
HETATM   20  C   UNL     1       0.263  -0.626   3.747  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.907   0.101   4.357  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.446   0.846   5.611  1.00  0.00           C  
HETATM   23  C   UNL     1       3.128   0.308   3.807  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.634   1.585   6.230  1.00  0.00           C  
HETATM   25  O   UNL     1       2.457  -0.448   2.797  1.00  0.00           O  
HETATM   26  O   UNL     1       0.511  -1.759   4.084  1.00  0.00           O  
HETATM   27  O   UNL     1      -1.923  -0.839   4.708  1.00  0.00           O  
HETATM   28  O   UNL     1       0.076  -0.089   6.556  1.00  0.00           O  
HETATM   29  H   UNL     1      -1.478   0.099   1.979  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.712   1.540   1.257  1.00  0.00           H  
HETATM   31  H   UNL     1       0.458  -1.282   1.169  1.00  0.00           H  
HETATM   32  H   UNL     1       1.679   1.422   0.490  1.00  0.00           H  
HETATM   33  H   UNL     1       2.452  -0.165   0.311  1.00  0.00           H  
HETATM   34  H   UNL     1       3.208   0.273  -4.437  1.00  0.00           H  
HETATM   35  H   UNL     1       2.322   0.112  -6.698  1.00  0.00           H  
HETATM   36  H   UNL     1       2.832   0.356  -2.011  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.444   0.879  -7.877  1.00  0.00           H  
HETATM   38  H   UNL     1       0.509  -0.602  -8.124  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.156  -0.709  -7.506  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.289   0.733  -5.342  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.680   0.789  -2.870  1.00  0.00           H  
HETATM   42  H   UNL     1       1.132   1.132   2.908  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.306   0.815   3.636  1.00  0.00           H  
HETATM   44  H   UNL     1       0.328   1.564   5.344  1.00  0.00           H  
HETATM   45  H   UNL     1       4.125  -0.101   3.965  1.00  0.00           H  
HETATM   46  H   UNL     1       3.208   1.347   3.489  1.00  0.00           H  
HETATM   47  H   UNL     1       2.562   0.255   4.737  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.306   2.116   7.124  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.033   2.299   5.510  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.409   0.868   6.498  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.529  -1.451   5.346  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.639  -0.704   6.766  1.00  0.00           H  
CONECT    1    2   13   16   16                                       
CONECT    2    1    3   29   30                                       
CONECT    3    2    4   19   31                                       
CONECT    4    3   14   32   33                                       
CONECT    5    6    6   11   34                                       
CONECT    6    5    5    7   35                                       
CONECT    7    6    8    8   15                                       
CONECT    8    7    7   12   17                                       
CONECT    9   12   12   13   18                                       
CONECT   10   11   11   14   36                                       
CONECT   11    5   10   10   12                                       
CONECT   12    8    9    9   11                                       
CONECT   13    1    9   14   14                                       
CONECT   14    4   10   13   13                                       
CONECT   15    7   37   38   39                                       
CONECT   16    1    1                                                 
CONECT   17    8   40                                                 
CONECT   18    9   41                                                 
CONECT   19    3   20   25   42                                       
CONECT   20   19   21   26   26                                       
CONECT   21   20   22   27   43                                       
CONECT   22   21   24   28   44                                       
CONECT   23   25   45   46   47                                       
CONECT   24   22   48   49   50                                       
CONECT   25   19   23                                                 
CONECT   26   20   20                                                 
CONECT   27   21   51                                                 
CONECT   28   22   52                                                 
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36   10                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
