COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.610  -2.015  -0.598  1.00  0.00           C  
HETATM    2  C   UNL     1       5.940  -1.494  -0.121  1.00  0.00           C  
HETATM    3  C   UNL     1       6.070  -0.210   0.209  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.396   3.212  -0.005  1.00  0.00           C  
HETATM    5  O   UNL     1      -4.651   1.808   0.083  1.00  0.00           O  
HETATM    6  C   UNL     1      -3.570   0.984   0.099  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.296   1.515   0.037  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.184   0.665   0.054  1.00  0.00           C  
HETATM    9  C   UNL     1       0.173   1.226  -0.012  1.00  0.00           C  
HETATM   10  C   UNL     1       1.245   0.405   0.004  1.00  0.00           C  
HETATM   11  C   UNL     1       2.594   0.963  -0.061  1.00  0.00           C  
HETATM   12  O   UNL     1       2.751   2.159  -0.220  1.00  0.00           O  
HETATM   13  N   UNL     1       3.665   0.152   0.056  1.00  0.00           N  
HETATM   14  C   UNL     1       3.476  -1.296   0.131  1.00  0.00           C  
HETATM   15  C   UNL     1       4.903   0.681   0.103  1.00  0.00           C  
HETATM   16  O   UNL     1       5.056   1.887   0.058  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.367  -0.720   0.133  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.644  -1.244   0.196  1.00  0.00           C  
HETATM   19  O   UNL     1      -2.823  -2.590   0.273  1.00  0.00           O  
HETATM   20  C   UNL     1      -1.647  -3.401   0.287  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.748  -0.395   0.184  1.00  0.00           C  
HETATM   22  O   UNL     1      -5.003  -0.914   0.251  1.00  0.00           O  
HETATM   23  C   UNL     1      -5.639  -1.234  -0.988  1.00  0.00           C  
HETATM   24  H   UNL     1       4.517  -1.842  -1.670  1.00  0.00           H  
HETATM   25  H   UNL     1       4.548  -3.084  -0.398  1.00  0.00           H  
HETATM   26  H   UNL     1       6.787  -2.160  -0.046  1.00  0.00           H  
HETATM   27  H   UNL     1       7.020   0.173   0.551  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.851   3.424  -0.925  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.341   3.754  -0.008  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.799   3.527   0.851  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.158   2.584  -0.025  1.00  0.00           H  
HETATM   32  H   UNL     1       0.313   2.295  -0.073  1.00  0.00           H  
HETATM   33  H   UNL     1       1.105  -0.664   0.066  1.00  0.00           H  
HETATM   34  H   UNL     1       2.525  -1.561  -0.331  1.00  0.00           H  
HETATM   35  H   UNL     1       3.465  -1.605   1.176  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.511  -1.379   0.146  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.079  -3.234  -0.629  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.033  -3.137   1.148  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.930  -4.452   0.352  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.632  -1.638  -0.793  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.726  -0.334  -1.596  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.043  -1.976  -1.521  1.00  0.00           H  
CONECT    1    2   14   24   25                                       
CONECT    2    1    3    3   26                                       
CONECT    3    2    2   15   27                                       
CONECT    4    5   28   29   30                                       
CONECT    5    4    6                                                 
CONECT    6    7    5   21   21                                       
CONECT    7    8    8    6   31                                       
CONECT    8    9    7    7   17                                       
CONECT    9   10   10    8   32                                       
CONECT   10   11    9    9   33                                       
CONECT   11   13   12   12   10                                       
CONECT   12   11   11                                                 
CONECT   13   14   15   11                                            
CONECT   14    1   13   34   35                                       
CONECT   15    3   13   16   16                                       
CONECT   16   15   15                                                 
CONECT   17    8   18   18   36                                       
CONECT   18   17   17   21   19                                       
CONECT   19   18   20                                                 
CONECT   20   19   37   38   39                                       
CONECT   21    6    6   18   22                                       
CONECT   22   21   23                                                 
CONECT   23   22   40   41   42                                       
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   17                                                      
CONECT   37   20                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
