COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.492  -2.165   1.568  1.00  0.00           C  
HETATM    2  C   UNL     1       1.287   1.187  -0.346  1.00  0.00           C  
HETATM    3  C   UNL     1       0.280   0.503   0.582  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.141   0.864   0.147  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.396   0.521   0.825  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.978   1.631   1.446  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.995   1.108   0.451  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.196  -0.271   0.001  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.628  -1.456  -0.686  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.760  -2.309  -0.007  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.234  -3.410  -0.651  1.00  0.00           C  
HETATM   12  C   UNL     1       5.194  -1.267   0.396  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.567  -3.668  -1.969  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.428  -2.825  -2.648  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.964  -1.724  -2.012  1.00  0.00           C  
HETATM   16  C   UNL     1       5.247   0.194   0.846  1.00  0.00           C  
HETATM   17  C   UNL     1       4.949   1.092  -0.327  1.00  0.00           C  
HETATM   18  C   UNL     1       5.984   1.627  -1.069  1.00  0.00           C  
HETATM   19  C   UNL     1       5.711   2.451  -2.145  1.00  0.00           C  
HETATM   20  C   UNL     1       4.402   2.742  -2.482  1.00  0.00           C  
HETATM   21  C   UNL     1       3.363   2.210  -1.742  1.00  0.00           C  
HETATM   22  C   UNL     1       3.635   1.378  -0.665  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.223   2.453   2.271  1.00  0.00           N  
HETATM   24  N   UNL     1      -5.265   1.887   1.236  1.00  0.00           N  
HETATM   25  N   UNL     1      -7.334   1.410   0.258  1.00  0.00           N  
HETATM   26  N   UNL     1      -5.481   0.053  -0.159  1.00  0.00           N  
HETATM   27  O   UNL     1       5.719  -1.686   2.654  1.00  0.00           O  
HETATM   28  O   UNL     1       5.500  -3.498   1.408  1.00  0.00           O  
HETATM   29  O   UNL     1       2.615   0.849   0.060  1.00  0.00           O  
HETATM   30  O   UNL     1      -2.081   0.226   1.014  1.00  0.00           O  
HETATM   31  H   UNL     1       1.123   0.850  -1.370  1.00  0.00           H  
HETATM   32  H   UNL     1       1.154   2.267  -0.293  1.00  0.00           H  
HETATM   33  H   UNL     1       0.413  -0.578   0.529  1.00  0.00           H  
HETATM   34  H   UNL     1       0.444   0.839   1.606  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.274   1.945   0.201  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.305   0.528  -0.877  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.499  -2.108   1.022  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.561  -4.072  -0.126  1.00  0.00           H  
HETATM   39  H   UNL     1       5.934  -1.434  -0.387  1.00  0.00           H  
HETATM   40  H   UNL     1       4.199  -1.492   0.009  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.152  -4.531  -2.469  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.684  -3.031  -3.677  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.639  -1.068  -2.542  1.00  0.00           H  
HETATM   44  H   UNL     1       4.508   0.361   1.628  1.00  0.00           H  
HETATM   45  H   UNL     1       6.242   0.419   1.232  1.00  0.00           H  
HETATM   46  H   UNL     1       7.008   1.401  -0.809  1.00  0.00           H  
HETATM   47  H   UNL     1       6.522   2.869  -2.724  1.00  0.00           H  
HETATM   48  H   UNL     1       4.191   3.386  -3.322  1.00  0.00           H  
HETATM   49  H   UNL     1       2.341   2.438  -2.005  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.284   2.260   2.419  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.634   3.221   2.698  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.879   0.852  -0.317  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.725   2.181   0.699  1.00  0.00           H  
HETATM   54  H   UNL     1       5.697  -4.033   2.189  1.00  0.00           H  
CONECT    1   27   27   28   12                                       
CONECT    2    3   29   31   32                                       
CONECT    3    4    2   33   34                                       
CONECT    4   30    3   35   36                                       
CONECT    5    6   30    8    8                                       
CONECT    6   23   24   24    5                                       
CONECT    7   24   25   26   26                                       
CONECT    8    5    5   26    9                                       
CONECT    9    8   10   10   15                                       
CONECT   10    9    9   11   37                                       
CONECT   11   10   13   13   38                                       
CONECT   12    1   16   39   40                                       
CONECT   13   11   11   14   41                                       
CONECT   14   15   15   13   42                                       
CONECT   15    9   14   14   43                                       
CONECT   16   12   17   44   45                                       
CONECT   17   16   22   22   18                                       
CONECT   18   17   19   19   46                                       
CONECT   19   18   18   20   47                                       
CONECT   20   21   21   19   48                                       
CONECT   21   22   20   20   49                                       
CONECT   22   29   17   17   21                                       
CONECT   23    6   50   51                                            
CONECT   24    6    6    7                                            
CONECT   25    7   52   53                                            
CONECT   26    7    7    8                                            
CONECT   27    1    1                                                 
CONECT   28    1   54                                                 
CONECT   29    2   22                                                 
CONECT   30    4    5                                                 
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   25                                                      
CONECT   53   25                                                      
CONECT   54   28                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
