COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.002   3.636   0.208  1.00  0.00           O  
HETATM    2  O   UNL     1      -6.803  -0.770  -1.001  1.00  0.00           O  
HETATM    3  O   UNL     1      -0.103   3.015   0.549  1.00  0.00           O  
HETATM    4  O   UNL     1      -5.720   1.157  -0.987  1.00  0.00           O  
HETATM    5 BR   UNL     1       4.857  -0.968  -0.321  1.00  0.00          Br  
HETATM    6  C   UNL     1       2.050  -1.411  -0.134  1.00  0.00           C  
HETATM    7  C   UNL     1       0.727  -1.046   0.005  1.00  0.00           C  
HETATM    8  C   UNL     1       2.730   0.884   0.019  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.313  -2.097   1.366  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.209  -1.047   1.505  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.615  -1.415   0.943  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.305   0.339  -0.262  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.945   0.662   0.295  1.00  0.00           N  
HETATM   14  C   UNL     1       1.046   2.692   0.319  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.692  -0.039  -0.817  1.00  0.00           C  
HETATM   16  C   UNL     1       3.049  -0.449  -0.128  1.00  0.00           C  
HETATM   17  C   UNL     1       0.386   0.293   0.154  1.00  0.00           C  
HETATM   18  C   UNL     1       1.394   1.270   0.161  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.003  -0.343   0.162  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.409  -0.711  -0.400  1.00  0.00           C  
HETATM   21  H   UNL     1       2.310  -2.453  -0.245  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.045  -1.802   0.000  1.00  0.00           H  
HETATM   23  H   UNL     1       3.511   1.630   0.023  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.025  -2.830   0.613  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.460  -2.598   2.323  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.497  -0.314   2.259  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.281  -1.533   1.806  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.402  -2.163   0.844  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.903  -0.682   1.696  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.593   1.072   0.492  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.158   0.840  -1.218  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.175   1.586   0.481  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.714  -1.076  -0.592  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.121  -1.444  -1.154  1.00  0.00           H  
HETATM   35  H   UNL     1       1.725   4.556   0.319  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.602  -0.294  -1.268  1.00  0.00           H  
CONECT    1   14   35                                                 
CONECT    2   15   36                                                 
CONECT    3   14   14                                                 
CONECT    4   15   15                                                 
CONECT    5   16                                                      
CONECT    6    7    7   16   21                                       
CONECT    7    6    6   17   22                                       
CONECT    8   16   16   18   23                                       
CONECT    9   10   11   24   25                                       
CONECT   10    9   19   26   27                                       
CONECT   11    9   20   28   29                                       
CONECT   12   19   20   30   31                                       
CONECT   13   17   19   32                                            
CONECT   14    1    3    3   18                                       
CONECT   15    2    4    4   20                                       
CONECT   16    5    6    8    8                                       
CONECT   17    7   13   18   18                                       
CONECT   18    8   14   17   17                                       
CONECT   19   10   12   13   33                                       
CONECT   20   11   12   15   34                                       
CONECT   21    6                                                      
CONECT   22    7                                                      
CONECT   23    8                                                      
CONECT   24    9                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   10                                                      
CONECT   28   11                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   19                                                      
CONECT   34   20                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
