COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.507   2.832  -0.078  1.00  0.00           C  
HETATM    2  C   UNL     1       2.138   2.723   0.133  1.00  0.00           C  
HETATM    3  C   UNL     1       1.512   1.490   0.027  1.00  0.00           C  
HETATM    4  C   UNL     1       2.287   0.353  -0.299  1.00  0.00           C  
HETATM    5  C   UNL     1       6.637  -0.649   0.277  1.00  0.00           C  
HETATM    6  C   UNL     1       8.145  -0.543   0.042  1.00  0.00           C  
HETATM    7  C   UNL     1       1.659  -0.909  -0.411  1.00  0.00           C  
HETATM    8  C   UNL     1       2.428  -2.018  -0.730  1.00  0.00           C  
HETATM    9  C   UNL     1       3.796  -1.883  -0.937  1.00  0.00           C  
HETATM   10  C   UNL     1       0.210  -0.998  -0.183  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.880  -0.019   0.338  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.366  -0.281   1.613  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.724  -0.403   1.828  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.608  -0.263   0.768  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.123   0.001  -0.514  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.759   0.128  -0.725  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.339  -0.115  -0.617  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.925  -0.587   1.771  1.00  0.00           C  
HETATM   19  C   UNL     1       0.068   1.321   0.240  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.619   2.284   0.521  1.00  0.00           O  
HETATM   21  N   UNL     1      -0.500   0.105   0.126  1.00  0.00           N  
HETATM   22  O   UNL     1      -0.352  -2.072  -0.274  1.00  0.00           O  
HETATM   23  C   UNL     1       4.420  -0.672  -0.833  1.00  0.00           C  
HETATM   24  C   UNL     1       5.905  -0.568  -1.064  1.00  0.00           C  
HETATM   25  O   UNL     1       8.829  -0.619   1.294  1.00  0.00           O  
HETATM   26  C   UNL     1       3.676   0.477  -0.512  1.00  0.00           C  
HETATM   27  C   UNL     1       4.271   1.745  -0.393  1.00  0.00           C  
HETATM   28  N   UNL     1      -5.231   0.087  -1.354  1.00  0.00           N  
HETATM   29  C   UNL     1      -5.196   0.353  -2.794  1.00  0.00           C  
HETATM   30  O   UNL     1      -7.477  -0.105  -1.046  1.00  0.00           O  
HETATM   31  N   UNL     1      -5.997  -0.329   0.668  1.00  0.00           N  
HETATM   32  C   UNL     1      -1.407  -0.434   2.766  1.00  0.00           C  
HETATM   33  H   UNL     1       3.978   3.800   0.005  1.00  0.00           H  
HETATM   34  H   UNL     1       1.559   3.601   0.382  1.00  0.00           H  
HETATM   35  H   UNL     1       6.410  -1.601   0.757  1.00  0.00           H  
HETATM   36  H   UNL     1       6.311   0.169   0.919  1.00  0.00           H  
HETATM   37  H   UNL     1       8.471  -1.361  -0.601  1.00  0.00           H  
HETATM   38  H   UNL     1       8.372   0.408  -0.439  1.00  0.00           H  
HETATM   39  H   UNL     1       1.963  -2.988  -0.819  1.00  0.00           H  
HETATM   40  H   UNL     1       4.381  -2.757  -1.184  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.098  -0.608   2.820  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.381   0.332  -1.716  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.948  -0.580   1.394  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.707  -1.561   2.210  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.812   0.187   2.530  1.00  0.00           H  
HETATM   46  H   UNL     1       6.132   0.384  -1.545  1.00  0.00           H  
HETATM   47  H   UNL     1       6.231  -1.386  -1.707  1.00  0.00           H  
HETATM   48  H   UNL     1       9.791  -0.559   1.221  1.00  0.00           H  
HETATM   49  H   UNL     1       5.333   1.860  -0.556  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.213   0.363  -3.187  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.728   1.321  -2.974  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.622  -0.427  -3.294  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.237   0.538   3.228  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.829  -1.117   3.502  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.461  -0.833   2.400  1.00  0.00           H  
CONECT    1    2   27   27   33                                       
CONECT    2    3    3    1   34                                       
CONECT    3   19    2    2    4                                       
CONECT    4    3   26   26    7                                       
CONECT    5   24    6   35   36                                       
CONECT    6    5   25   37   38                                       
CONECT    7    4   10    8    8                                       
CONECT    8    7    7    9   39                                       
CONECT    9    8   23   23   40                                       
CONECT   10   21    7   22   22                                       
CONECT   11   16   16   12   21                                       
CONECT   12   13   13   11   32                                       
CONECT   13   14   12   12   41                                       
CONECT   14   31   15   15   13                                       
CONECT   15   28   14   14   16                                       
CONECT   16   15   11   11   42                                       
CONECT   17   30   30   28   31                                       
CONECT   18   31   43   44   45                                       
CONECT   19   20   20   21    3                                       
CONECT   20   19   19                                                 
CONECT   21   11   19   10                                            
CONECT   22   10   10                                                 
CONECT   23   26    9    9   24                                       
CONECT   24   23    5   46   47                                       
CONECT   25    6   48                                                 
CONECT   26    4    4   27   23                                       
CONECT   27    1    1   26   49                                       
CONECT   28   29   17   15                                            
CONECT   29   28   50   51   52                                       
CONECT   30   17   17                                                 
CONECT   31   17   18   14                                            
CONECT   32   12   53   54   55                                       
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   13                                                      
CONECT   42   16                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   27                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   32                                                      
CONECT   54   32                                                      
CONECT   55   32                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
