COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.631  -1.546  -1.186  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.540  -2.564  -0.981  1.00  0.00           C  
HETATM    3  O   UNL     1      -3.361  -3.103  -1.923  1.00  0.00           O  
HETATM    4  C   UNL     1      -4.060  -4.095  -1.144  1.00  0.00           C  
HETATM    5  O   UNL     1      -3.648  -4.131   0.238  1.00  0.00           O  
HETATM    6  C   UNL     1      -2.704  -3.151   0.253  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.968  -2.752   1.350  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.040  -1.724   1.170  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.873  -1.124  -0.091  1.00  0.00           C  
HETATM   10  O   UNL     1       0.037  -0.122  -0.244  1.00  0.00           O  
HETATM   11  C   UNL     1       1.329  -0.475  -0.595  1.00  0.00           C  
HETATM   12  N   UNL     1       1.570  -1.787  -0.754  1.00  0.00           N  
HETATM   13  C   UNL     1       2.262   0.519  -0.756  1.00  0.00           C  
HETATM   14  C   UNL     1       3.525   0.085  -1.106  1.00  0.00           C  
HETATM   15  C   UNL     1       4.616   1.083  -1.304  1.00  0.00           C  
HETATM   16  N   UNL     1       3.849  -1.212  -1.284  1.00  0.00           N  
HETATM   17  C   UNL     1       2.838  -2.082  -1.094  1.00  0.00           C  
HETATM   18  O   UNL     1       3.134  -3.414  -1.269  1.00  0.00           O  
HETATM   19  C   UNL     1       2.109  -4.316  -1.079  1.00  0.00           C  
HETATM   20  C   UNL     1       1.897  -4.849   0.184  1.00  0.00           C  
HETATM   21  C   UNL     1       0.860  -5.761   0.377  1.00  0.00           C  
HETATM   22  C   UNL     1       1.308  -4.672  -2.153  1.00  0.00           C  
HETATM   23  C   UNL     1       0.270  -5.584  -1.959  1.00  0.00           C  
HETATM   24  C   UNL     1       0.046  -6.128  -0.695  1.00  0.00           C  
HETATM   25  N   UNL     1      -0.983  -7.032  -0.503  1.00  0.00           N  
HETATM   26  C   UNL     1      -1.322  -7.647   0.675  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.396  -8.448   0.365  1.00  0.00           C  
HETATM   28  N   UNL     1      -2.726  -8.343  -0.963  1.00  0.00           N  
HETATM   29  C   UNL     1      -1.859  -7.486  -1.456  1.00  0.00           C  
HETATM   30  H   UNL     1      -1.509  -1.090  -2.162  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.881  -5.081  -1.588  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.134  -3.881  -1.184  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.100  -3.217   2.321  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.445  -1.386   2.015  1.00  0.00           H  
HETATM   35  H   UNL     1       2.027   1.567  -0.618  1.00  0.00           H  
HETATM   36  H   UNL     1       5.164   1.241  -0.368  1.00  0.00           H  
HETATM   37  H   UNL     1       5.326   0.749  -2.072  1.00  0.00           H  
HETATM   38  H   UNL     1       4.215   2.049  -1.640  1.00  0.00           H  
HETATM   39  H   UNL     1       2.528  -4.566   1.023  1.00  0.00           H  
HETATM   40  H   UNL     1       0.696  -6.176   1.368  1.00  0.00           H  
HETATM   41  H   UNL     1       1.478  -4.252  -3.140  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.356  -5.863  -2.804  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.790  -7.469   1.599  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.949  -9.095   1.031  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.817  -7.160  -2.487  1.00  0.00           H  
CONECT    1    9    9    2   30                                       
CONECT    2    1    3    6    6                                       
CONECT    3    2    4                                                 
CONECT    4    3    5   31   32                                       
CONECT    5    4    6                                                 
CONECT    6    2    2    5    7                                       
CONECT    7    6    8    8   33                                       
CONECT    8    7    7    9   34                                       
CONECT    9    1    1    8   10                                       
CONECT   10    9   11                                                 
CONECT   11   10   13   13   12                                       
CONECT   12   11   17   17                                            
CONECT   13   11   11   14   35                                       
CONECT   14   13   15   16   16                                       
CONECT   15   14   36   37   38                                       
CONECT   16   14   14   17                                            
CONECT   17   12   12   16   18                                       
CONECT   18   17   19                                                 
CONECT   19   18   20   20   22                                       
CONECT   20   19   19   21   39                                       
CONECT   21   20   24   24   40                                       
CONECT   22   19   23   23   41                                       
CONECT   23   22   22   24   42                                       
CONECT   24   21   21   23   25                                       
CONECT   25   24   26   29                                            
CONECT   26   25   27   27   43                                       
CONECT   27   26   26   28   44                                       
CONECT   28   27   29   29                                            
CONECT   29   25   28   28   45                                       
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   13                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   26                                                      
CONECT   44   27                                                      
CONECT   45   29                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
