COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.443   0.096  -1.252  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.811   0.142  -1.078  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.349   0.175   0.196  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.520   0.161   1.304  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.150   0.114   1.143  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.602   0.081  -0.139  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.132   0.031  -0.318  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.656   0.002  -1.439  1.00  0.00           O  
HETATM    9  N   UNL     1      -2.327   0.016   0.753  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.014  -0.029   0.593  1.00  0.00           C  
HETATM   11  S   UNL     1      -0.186  -0.073  -0.916  1.00  0.00           S  
HETATM   12  N   UNL     1      -0.092  -0.042   1.592  1.00  0.00           N  
HETATM   13  C   UNL     1       1.202  -0.088   1.309  1.00  0.00           C  
HETATM   14  O   UNL     1       2.073  -0.102   2.152  1.00  0.00           O  
HETATM   15  C   UNL     1       1.475  -0.120  -0.173  1.00  0.00           C  
HETATM   16  O   UNL     1       2.223   1.021  -0.574  1.00  0.00           O  
HETATM   17  C   UNL     1       3.537   1.089  -0.015  1.00  0.00           C  
HETATM   18  C   UNL     1       4.241   2.351  -0.518  1.00  0.00           C  
HETATM   19  O   UNL     1       3.560   3.506  -0.023  1.00  0.00           O  
HETATM   20  C   UNL     1       4.335  -0.145  -0.443  1.00  0.00           C  
HETATM   21  O   UNL     1       5.635  -0.103   0.150  1.00  0.00           O  
HETATM   22  C   UNL     1       3.601  -1.407   0.023  1.00  0.00           C  
HETATM   23  O   UNL     1       4.309  -2.565  -0.425  1.00  0.00           O  
HETATM   24  C   UNL     1       2.188  -1.408  -0.570  1.00  0.00           C  
HETATM   25  O   UNL     1       1.460  -2.530  -0.066  1.00  0.00           O  
HETATM   26  H   UNL     1      -5.024   0.067  -2.247  1.00  0.00           H  
HETATM   27  H   UNL     1      -7.463   0.154  -1.939  1.00  0.00           H  
HETATM   28  H   UNL     1      -8.420   0.212   0.326  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.946   0.187   2.296  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.504   0.103   2.009  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.383  -0.017   2.517  1.00  0.00           H  
HETATM   32  H   UNL     1       2.249  -1.471  -1.656  1.00  0.00           H  
HETATM   33  H   UNL     1       3.469   1.120   1.072  1.00  0.00           H  
HETATM   34  H   UNL     1       5.272   2.358  -0.164  1.00  0.00           H  
HETATM   35  H   UNL     1       4.231   2.363  -1.608  1.00  0.00           H  
HETATM   36  H   UNL     1       4.431  -0.159  -1.529  1.00  0.00           H  
HETATM   37  H   UNL     1       3.952   4.344  -0.303  1.00  0.00           H  
HETATM   38  H   UNL     1       6.155   0.674  -0.099  1.00  0.00           H  
HETATM   39  H   UNL     1       3.542  -1.413   1.111  1.00  0.00           H  
HETATM   40  H   UNL     1       5.215  -2.624  -0.094  1.00  0.00           H  
HETATM   41  H   UNL     1       1.858  -3.385  -0.282  1.00  0.00           H  
CONECT    1    2    6    6   26                                       
CONECT    2    1    3    3   27                                       
CONECT    3    2    2    4   28                                       
CONECT    4    3    5    5   29                                       
CONECT    5    4    4    6   30                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   10   10                                            
CONECT   10    9    9   11   12                                       
CONECT   11   10   15                                                 
CONECT   12   10   13   31                                            
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   11   13   16   24                                       
CONECT   16   15   17                                                 
CONECT   17   16   18   20   33                                       
CONECT   18   17   19   34   35                                       
CONECT   19   18   37                                                 
CONECT   20   17   21   22   36                                       
CONECT   21   20   38                                                 
CONECT   22   20   23   24   39                                       
CONECT   23   22   40                                                 
CONECT   24   15   22   25   32                                       
CONECT   25   24   41                                                 
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31   12                                                      
CONECT   32   24                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   20                                                      
CONECT   37   19                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   25                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
