COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.952   0.533   0.849  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.842  -0.446   0.377  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.118  -0.053  -0.100  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.464   1.309  -0.101  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.573   2.230   0.359  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.321   1.843   0.833  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.499  -1.809   0.383  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.389  -2.730  -0.077  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.641  -2.343  -0.551  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.011  -1.033  -0.568  1.00  0.00           C  
HETATM   11  C   UNL     1       0.407   0.135   1.365  1.00  0.00           C  
HETATM   12  C   UNL     1       1.383   0.017   0.193  1.00  0.00           C  
HETATM   13  C   UNL     1       4.766  -1.732   0.585  1.00  0.00           C  
HETATM   14  C   UNL     1       3.407  -1.334   0.069  1.00  0.00           C  
HETATM   15  N   UNL     1       2.704  -0.370   0.695  1.00  0.00           N  
HETATM   16  O   UNL     1       2.946  -1.883  -0.910  1.00  0.00           O  
HETATM   17  O   UNL     1       2.361   1.317  -1.603  1.00  0.00           O  
HETATM   18  O   UNL     1       0.256   1.784  -1.024  1.00  0.00           O  
HETATM   19  O   UNL     1       1.940   2.372   0.318  1.00  0.00           O  
HETATM   20  B   UNL     1       1.489   1.423  -0.556  1.00  0.00           B1-
HETATM   21  H   UNL     1      -4.431   1.623  -0.465  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.842   3.276   0.358  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.634   2.594   1.193  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.532  -2.123   0.748  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.121  -3.776  -0.075  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.329  -3.094  -0.911  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.985  -0.748  -0.937  1.00  0.00           H  
HETATM   28  H   UNL     1       0.335  -0.824   1.877  1.00  0.00           H  
HETATM   29  H   UNL     1       0.766   0.892   2.062  1.00  0.00           H  
HETATM   30  H   UNL     1       1.023  -0.740  -0.504  1.00  0.00           H  
HETATM   31  H   UNL     1       5.530  -1.119   0.107  1.00  0.00           H  
HETATM   32  H   UNL     1       4.803  -1.582   1.664  1.00  0.00           H  
HETATM   33  H   UNL     1       4.948  -2.782   0.357  1.00  0.00           H  
HETATM   34  H   UNL     1       3.073   0.069   1.478  1.00  0.00           H  
HETATM   35  H   UNL     1       2.006   0.639  -2.195  1.00  0.00           H  
HETATM   36  H   UNL     1       0.364   2.636  -1.468  1.00  0.00           H  
HETATM   37  H   UNL     1       1.298   2.415   1.040  1.00  0.00           H  
CONECT    1    2    2    6   11                                       
CONECT    2    1    1    3    7                                       
CONECT    3    2    4    4   10                                       
CONECT    4    3    3    5   21                                       
CONECT    5    4    6    6   22                                       
CONECT    6    1    5    5   23                                       
CONECT    7    2    8    8   24                                       
CONECT    8    7    7    9   25                                       
CONECT    9    8   10   10   26                                       
CONECT   10    3    9    9   27                                       
CONECT   11    1   12   28   29                                       
CONECT   12   11   15   20   30                                       
CONECT   13   14   31   32   33                                       
CONECT   14   13   15   16   16                                       
CONECT   15   12   14   34                                            
CONECT   16   14   14                                                 
CONECT   17   20   35                                                 
CONECT   18   20   36                                                 
CONECT   19   20   37                                                 
CONECT   20   12   17   18   19                                       
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    9                                                      
CONECT   27   10                                                      
CONECT   28   11                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
