COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.473   4.757  -0.084  1.00  0.00           C  
HETATM    2  N   UNL     1      -4.503  -0.941   1.178  1.00  0.00           N  
HETATM    3  O   UNL     1       1.819   3.373  -0.002  1.00  0.00           O  
HETATM    4  C   UNL     1       0.793   2.480   0.007  1.00  0.00           C  
HETATM    5  N   UNL     1      -4.433  -1.044  -1.172  1.00  0.00           N  
HETATM    6  O   UNL     1       2.340   0.672   0.152  1.00  0.00           O  
HETATM    7  C   UNL     1       1.056   1.116   0.084  1.00  0.00           C  
HETATM    8  O   UNL     1      -5.959  -2.105   0.008  1.00  0.00           O  
HETATM    9  C   UNL     1       2.533  -0.730   0.346  1.00  0.00           C  
HETATM   10  C   UNL     1       2.469  -1.475  -1.007  1.00  0.00           C  
HETATM   11  C   UNL     1       3.873  -2.137  -1.160  1.00  0.00           C  
HETATM   12  C   UNL     1       3.889  -3.269  -0.087  1.00  0.00           C  
HETATM   13  C   UNL     1       3.953  -2.524   1.266  1.00  0.00           C  
HETATM   14  C   UNL     1       3.969  -1.013   0.884  1.00  0.00           C  
HETATM   15  C   UNL     1       4.778  -1.062  -0.461  1.00  0.00           C  
HETATM   16  C   UNL     1       0.008   0.210   0.093  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.297   0.662   0.025  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.559   2.017  -0.053  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.517   2.927  -0.056  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.436  -0.324   0.034  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.341  -0.054   1.241  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.985  -1.378   0.005  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.267  -0.163  -1.243  1.00  0.00           C  
HETATM   24  H   UNL     1       0.918   4.939  -1.004  1.00  0.00           H  
HETATM   25  H   UNL     1       0.856   5.028   0.772  1.00  0.00           H  
HETATM   26  H   UNL     1       2.382   5.359  -0.082  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.932  -1.222   2.002  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.816  -1.394  -1.992  1.00  0.00           H  
HETATM   29  H   UNL     1       1.784  -1.125   1.032  1.00  0.00           H  
HETATM   30  H   UNL     1       1.690  -2.237  -0.985  1.00  0.00           H  
HETATM   31  H   UNL     1       2.291  -0.771  -1.820  1.00  0.00           H  
HETATM   32  H   UNL     1       4.152  -2.434  -2.171  1.00  0.00           H  
HETATM   33  H   UNL     1       2.978  -3.865  -0.150  1.00  0.00           H  
HETATM   34  H   UNL     1       4.768  -3.901  -0.215  1.00  0.00           H  
HETATM   35  H   UNL     1       3.074  -2.754   1.868  1.00  0.00           H  
HETATM   36  H   UNL     1       4.863  -2.790   1.803  1.00  0.00           H  
HETATM   37  H   UNL     1       4.333  -0.331   1.652  1.00  0.00           H  
HETATM   38  H   UNL     1       5.797  -1.420  -0.312  1.00  0.00           H  
HETATM   39  H   UNL     1       4.757  -0.107  -0.985  1.00  0.00           H  
HETATM   40  H   UNL     1       0.210  -0.849   0.153  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.579   2.367  -0.107  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.725   3.985  -0.111  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.041  -1.339   0.093  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.673   0.984   1.223  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.787  -0.244   2.161  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.660  -0.432  -2.108  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.596   0.871  -1.336  1.00  0.00           H  
CONECT    1    3   24   25   26                                       
CONECT    2   21   22   27                                            
CONECT    3    1    4                                                 
CONECT    4    3    7    7   19                                       
CONECT    5   22   23   28                                            
CONECT    6    7    9                                                 
CONECT    7    4    4    6   16                                       
CONECT    8   22   22                                                 
CONECT    9    6   10   14   29                                       
CONECT   10    9   11   30   31                                       
CONECT   11   10   12   15   32                                       
CONECT   12   11   13   33   34                                       
CONECT   13   12   14   35   36                                       
CONECT   14    9   13   15   37                                       
CONECT   15   11   14   38   39                                       
CONECT   16    7   17   17   40                                       
CONECT   17   16   16   18   20                                       
CONECT   18   17   19   19   41                                       
CONECT   19    4   18   18   42                                       
CONECT   20   17   21   23   43                                       
CONECT   21    2   20   44   45                                       
CONECT   22    2    5    8    8                                       
CONECT   23    5   20   46   47                                       
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    5                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
