COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.074  -1.754  -0.885  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.892  -1.062  -1.071  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.814   0.284  -0.736  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.926   0.933  -0.212  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.099   0.238  -0.029  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.176  -1.105  -0.371  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.585  -1.545  -0.049  1.00  0.00           C  
HETATM    8  O   UNL     1      -5.219   1.290  -0.439  1.00  0.00           O  
HETATM    9  C   UNL     1       6.256   0.313  -0.283  1.00  0.00           C  
HETATM   10  C   UNL     1       5.080   0.824  -0.798  1.00  0.00           C  
HETATM   11  C   UNL     1       6.243  -0.389   0.908  1.00  0.00           C  
HETATM   12  C   UNL     1       5.055  -0.577   1.591  1.00  0.00           C  
HETATM   13  C   UNL     1       3.877  -0.064   1.084  1.00  0.00           C  
HETATM   14  C   UNL     1       3.885   0.632  -0.118  1.00  0.00           C  
HETATM   15  S   UNL     1       1.588  -1.160   0.075  1.00  0.00           S  
HETATM   16  N   UNL     1       0.382   0.984  -0.925  1.00  0.00           N  
HETATM   17  N   UNL     1       2.693   1.148  -0.637  1.00  0.00           N  
HETATM   18  C   UNL     1       1.552   0.437  -0.539  1.00  0.00           C  
HETATM   19  B   UNL     1      -4.504   0.629   0.522  1.00  0.00           B1+
HETATM   20  O   UNL     1      -5.126  -0.558   0.846  1.00  0.00           O  
HETATM   21  O   UNL     1      -4.373   1.410   1.636  1.00  0.00           O  
HETATM   22  H   UNL     1      -2.135  -2.800  -1.145  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.029  -1.568  -1.478  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.869   1.979   0.050  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.180  -1.590  -0.961  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.570  -2.522   0.435  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.103   1.559  -0.155  1.00  0.00           H  
HETATM   28  H   UNL     1       7.185   0.458  -0.814  1.00  0.00           H  
HETATM   29  H   UNL     1       5.091   1.372  -1.729  1.00  0.00           H  
HETATM   30  H   UNL     1       7.163  -0.791   1.307  1.00  0.00           H  
HETATM   31  H   UNL     1       5.048  -1.126   2.521  1.00  0.00           H  
HETATM   32  H   UNL     1       2.949  -0.212   1.617  1.00  0.00           H  
HETATM   33  H   UNL     1       0.369   1.864  -1.335  1.00  0.00           H  
HETATM   34  H   UNL     1       2.687   2.018  -1.067  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.214   1.685   2.025  1.00  0.00           H  
CONECT    1    2    2    6   22                                       
CONECT    2    3    1    1   23                                       
CONECT    3   16    4    4    2                                       
CONECT    4    3    3    5   24                                       
CONECT    5    4   19    6    6                                       
CONECT    6    5    5    1    7                                       
CONECT    7    6   20   25   26                                       
CONECT    8   19   27                                                 
CONECT    9   10   10   11   28                                       
CONECT   10    9    9   14   29                                       
CONECT   11    9   12   12   30                                       
CONECT   12   11   11   13   31                                       
CONECT   13   14   14   12   32                                       
CONECT   14   10   17   13   13                                       
CONECT   15   18   18                                                 
CONECT   16   18    3   33                                            
CONECT   17   18   14   34                                            
CONECT   18   15   15   17   16                                       
CONECT   19   21    5   20    8                                       
CONECT   20   19    7                                                 
CONECT   21   19   35                                                 
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    4                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   16                                                      
CONECT   34   17                                                      
CONECT   35   21                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
