COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.511   1.525   4.545  1.00  0.00           C  
HETATM    2  C   UNL     1       2.427   1.665   5.762  1.00  0.00           C  
HETATM    3  C   UNL     1       0.964   0.098   4.480  1.00  0.00           C  
HETATM    4  O   UNL     1       2.051  -0.823   4.367  1.00  0.00           O  
HETATM    5  C   UNL     1       0.061  -0.040   3.281  1.00  0.00           C  
HETATM    6  C   UNL     1       0.179  -0.198   5.736  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.289  -0.142   3.398  1.00  0.00           C  
HETATM    8  C   UNL     1       0.644  -0.057   2.006  1.00  0.00           C  
HETATM    9  O   UNL     1       0.654  -0.830   6.650  1.00  0.00           O  
HETATM   10  O   UNL     1      -1.086   0.281   5.781  1.00  0.00           O  
HETATM   11  C   UNL     1      -2.074  -0.244   2.230  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.991  -0.153   4.730  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.145  -0.165   0.882  1.00  0.00           C  
HETATM   14  O   UNL     1      -3.289  -0.321   2.326  1.00  0.00           O  
HETATM   15  N   UNL     1      -1.502  -0.256   1.011  1.00  0.00           N  
HETATM   16  C   UNL     1       0.226  -0.203  -0.551  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.097  -0.358  -0.327  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.952  -0.319  -1.307  1.00  0.00           C  
HETATM   19  N   UNL     1       1.408  -0.146  -1.144  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.898  -0.374  -2.665  1.00  0.00           C  
HETATM   21  C   UNL     1       1.524  -0.194  -2.471  1.00  0.00           C  
HETATM   22  C   UNL     1       0.367  -0.310  -3.283  1.00  0.00           C  
HETATM   23  C   UNL     1       2.789  -0.129  -3.087  1.00  0.00           C  
HETATM   24  C   UNL     1       0.498  -0.359  -4.678  1.00  0.00           C  
HETATM   25  C   UNL     1       2.884  -0.179  -4.442  1.00  0.00           C  
HETATM   26  C   UNL     1       1.742  -0.294  -5.241  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.723  -0.482  -5.551  1.00  0.00           C  
HETATM   28  N   UNL     1      -1.218   0.857  -5.892  1.00  0.00           N  
HETATM   29  C   UNL     1      -2.403   0.667  -6.739  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.688   1.465  -4.640  1.00  0.00           C  
HETATM   31  O   UNL     1       1.870  -0.340  -6.593  1.00  0.00           O  
HETATM   32  H   UNL     1       0.682   2.228   4.631  1.00  0.00           H  
HETATM   33  H   UNL     1       2.077   1.739   3.638  1.00  0.00           H  
HETATM   34  H   UNL     1       2.817   2.682   5.809  1.00  0.00           H  
HETATM   35  H   UNL     1       1.861   1.451   6.669  1.00  0.00           H  
HETATM   36  H   UNL     1       3.256   0.963   5.676  1.00  0.00           H  
HETATM   37  H   UNL     1       2.602  -0.703   5.152  1.00  0.00           H  
HETATM   38  H   UNL     1       1.716   0.014   1.904  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.337  -1.164   4.947  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.849   0.517   4.692  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.641  -1.297  -0.424  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.768   0.482  -0.503  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.799  -0.465  -3.253  1.00  0.00           H  
HETATM   44  H   UNL     1       3.681  -0.040  -2.485  1.00  0.00           H  
HETATM   45  H   UNL     1       3.857  -0.129  -4.909  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.465  -1.017  -6.464  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.498  -1.030  -5.015  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.809   1.638  -7.020  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.123   0.116  -7.637  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.157   0.103  -6.188  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.067   2.467  -4.842  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.484   0.854  -4.216  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.860   1.526  -3.933  1.00  0.00           H  
HETATM   54  H   UNL     1       1.830   0.572  -6.909  1.00  0.00           H  
CONECT    1    2    3   32   33                                       
CONECT    2    1   34   35   36                                       
CONECT    3    1    4    5    6                                       
CONECT    4    3   37                                                 
CONECT    5    3    7    7    8                                       
CONECT    6    3    9    9   10                                       
CONECT    7    5    5   11   12                                       
CONECT    8    5   13   13   38                                       
CONECT    9    6    6                                                 
CONECT   10    6   12                                                 
CONECT   11    7   14   14   15                                       
CONECT   12    7   10   39   40                                       
CONECT   13    8    8   15   16                                       
CONECT   14   11   11                                                 
CONECT   15   11   13   17                                            
CONECT   16   13   18   18   19                                       
CONECT   17   15   18   41   42                                       
CONECT   18   16   16   17   20                                       
CONECT   19   16   21   21                                            
CONECT   20   18   22   22   43                                       
CONECT   21   19   19   22   23                                       
CONECT   22   20   20   21   24                                       
CONECT   23   21   25   25   44                                       
CONECT   24   22   26   26   27                                       
CONECT   25   23   23   26   45                                       
CONECT   26   24   24   25   31                                       
CONECT   27   24   28   46   47                                       
CONECT   28   27   29   30                                            
CONECT   29   28   48   49   50                                       
CONECT   30   28   51   52   53                                       
CONECT   31   26   54                                                 
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    8                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   20                                                      
CONECT   44   23                                                      
CONECT   45   25                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   30                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
