COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.911  -0.216   0.068  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.852  -1.341  -0.157  1.00  0.00           C  
HETATM    3  C   UNL     1       6.723   0.927  -0.017  1.00  0.00           C  
HETATM    4  C   UNL     1       6.170   2.168  -0.100  1.00  0.00           C  
HETATM    5  C   UNL     1       2.473   1.469  -0.036  1.00  0.00           C  
HETATM    6  C   UNL     1       3.689  -1.208   0.138  1.00  0.00           C  
HETATM    7  C   UNL     1       4.262  -2.442   0.221  1.00  0.00           C  
HETATM    8  C   UNL     1       5.648  -2.587   0.236  1.00  0.00           C  
HETATM    9  C   UNL     1       6.468  -1.503   0.155  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.534  -0.436  -0.113  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.996  -0.237  -0.118  1.00  0.00           C  
HETATM   12  N   UNL     1       1.679   0.442  -0.072  1.00  0.00           N  
HETATM   13  N   UNL     1       0.290   0.630  -0.076  1.00  0.00           N  
HETATM   14  C   UNL     1       4.502  -0.071   0.060  1.00  0.00           C  
HETATM   15  C   UNL     1       4.795   2.358  -0.105  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.221  -1.153  -0.167  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.748   0.136  -0.134  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.898   1.237  -0.090  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.527   1.055  -0.085  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.485   3.579  -0.014  1.00  0.00           C  
HETATM   21  C   UNL     1       3.931   1.272  -0.031  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.753   0.367   1.123  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.446  -3.519  -0.243  1.00  0.00           C  
HETATM   24  O   UNL     1      -0.073  -1.561  -0.143  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.055  -2.226  -0.210  1.00  0.00           O  
HETATM   26  O   UNL     1      -6.095   0.319  -0.144  1.00  0.00           O  
HETATM   27  O   UNL     1      -4.415   2.495  -0.058  1.00  0.00           O  
HETATM   28  H   UNL     1      -2.444  -2.341  -0.183  1.00  0.00           H  
HETATM   29  H   UNL     1       7.798   0.821  -0.016  1.00  0.00           H  
HETATM   30  H   UNL     1       6.819   3.029  -0.164  1.00  0.00           H  
HETATM   31  H   UNL     1       2.064   2.468  -0.010  1.00  0.00           H  
HETATM   32  H   UNL     1       2.613  -1.108   0.128  1.00  0.00           H  
HETATM   33  H   UNL     1       3.634  -3.318   0.276  1.00  0.00           H  
HETATM   34  H   UNL     1       6.078  -3.576   0.303  1.00  0.00           H  
HETATM   35  H   UNL     1       7.540  -1.633   0.158  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.078   1.527  -0.053  1.00  0.00           H  
HETATM   37  H   UNL     1       4.392   3.358  -0.172  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.868   1.909  -0.051  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.869   3.493   0.881  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.848   3.546  -0.898  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.029   4.523   0.008  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.822   0.516   0.972  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.589  -0.571   1.654  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.350   1.192   1.711  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.816  -3.602  -1.128  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.837  -3.657   0.650  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.221  -4.285  -0.276  1.00  0.00           H  
CONECT    1    3    3   14    9                                       
CONECT    2   16   16   11   28                                       
CONECT    3    4    1    1   29                                       
CONECT    4   15   15    3   30                                       
CONECT    5   12   12   21   31                                       
CONECT    6   14    7    7   32                                       
CONECT    7    6    6    8   33                                       
CONECT    8    9    9    7   34                                       
CONECT    9    1    8    8   35                                       
CONECT   10   11   24   24   13                                       
CONECT   11   19   19    2   10                                       
CONECT   12   13    5    5                                            
CONECT   13   10   12   36                                            
CONECT   14   21   21    1    6                                       
CONECT   15    4    4   21   37                                       
CONECT   16   17   25    2    2                                       
CONECT   17   26   18   18   16                                       
CONECT   18   27   17   17   19                                       
CONECT   19   18   11   11   38                                       
CONECT   20   27   39   40   41                                       
CONECT   21   15    5   14   14                                       
CONECT   22   26   42   43   44                                       
CONECT   23   25   45   46   47                                       
CONECT   24   10   10                                                 
CONECT   25   16   23                                                 
CONECT   26   22   17                                                 
CONECT   27   20   18                                                 
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   13                                                      
CONECT   37   15                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
