COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.658   1.354  -0.723  1.00  0.00           C  
HETATM    2  C   UNL     1       1.454   0.260  -1.023  1.00  0.00           C  
HETATM    3  C   UNL     1       0.881  -0.998  -1.158  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.761   3.576   0.004  1.00  0.00           O  
HETATM    5  C   UNL     1      -3.171  -0.813   0.763  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.670  -0.781   0.913  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.094  -2.535  -1.135  1.00  0.00           C  
HETATM    8  C   UNL     1       1.748  -2.186  -1.485  1.00  0.00           C  
HETATM    9  C   UNL     1       3.596   0.198  -0.115  1.00  0.00           C  
HETATM   10  C   UNL     1       4.979   0.243  -0.259  1.00  0.00           C  
HETATM   11  C   UNL     1       5.224  -0.239   1.965  1.00  0.00           C  
HETATM   12  C   UNL     1       3.850  -0.279   2.112  1.00  0.00           C  
HETATM   13  O   UNL     1      -5.260  -1.469   1.903  1.00  0.00           O  
HETATM   14  O   UNL     1      -5.341  -0.137   0.142  1.00  0.00           O  
HETATM   15  C   UNL     1      -2.760   0.047  -0.433  1.00  0.00           C  
HETATM   16  O   UNL     1      -3.076   1.413  -0.169  1.00  0.00           O  
HETATM   17  B   UNL     1      -1.879   2.177  -0.214  1.00  0.00           B  
HETATM   18  C   UNL     1      -1.281  -0.083  -0.683  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.711   1.183  -0.552  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.482  -1.165  -0.993  1.00  0.00           C  
HETATM   21  O   UNL     1       2.794   0.418  -1.187  1.00  0.00           O  
HETATM   22  N   UNL     1       3.065  -0.065   1.070  1.00  0.00           N  
HETATM   23  N   UNL     1       5.757   0.024   0.784  1.00  0.00           N  
HETATM   24  H   UNL     1       1.100   2.334  -0.617  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.599   4.015   0.200  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.707  -0.421   1.668  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.843  -1.840   0.602  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.300  -2.733  -2.187  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.400  -3.284  -0.753  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.024  -2.578  -0.568  1.00  0.00           H  
HETATM   31  H   UNL     1       2.099  -2.645  -0.560  1.00  0.00           H  
HETATM   32  H   UNL     1       1.168  -2.913  -2.053  1.00  0.00           H  
HETATM   33  H   UNL     1       2.603  -1.860  -2.076  1.00  0.00           H  
HETATM   34  H   UNL     1       5.416   0.457  -1.224  1.00  0.00           H  
HETATM   35  H   UNL     1       5.862  -0.414   2.818  1.00  0.00           H  
HETATM   36  H   UNL     1       3.417  -0.486   3.080  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.224  -1.418   1.959  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.296  -0.285  -1.322  1.00  0.00           H  
CONECT    1   19    2    2   24                                       
CONECT    2    1    1    3   21                                       
CONECT    3   20   20    2    8                                       
CONECT    4   17   25                                                 
CONECT    5    6   15   26   27                                       
CONECT    6   14   14    5   13                                       
CONECT    7   20   28   29   30                                       
CONECT    8    3   31   32   33                                       
CONECT    9   10   10   22   21                                       
CONECT   10   23    9    9   34                                       
CONECT   11   23   23   12   35                                       
CONECT   12   11   22   22   36                                       
CONECT   13    6   37                                                 
CONECT   14    6    6                                                 
CONECT   15    5   16   18   38                                       
CONECT   16   17   15                                                 
CONECT   17    4   16   19                                            
CONECT   18   15   19   19   20                                       
CONECT   19   17   18   18    1                                       
CONECT   20   18    7    3    3                                       
CONECT   21    9    2                                                 
CONECT   22   12   12    9                                            
CONECT   23   11   11   10                                            
CONECT   24    1                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    7                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
