COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.896   2.493   0.702  1.00  0.00           C  
HETATM    2  C   UNL     1       1.365  -1.977  -0.903  1.00  0.00           C  
HETATM    3  O   UNL     1      -3.096  -0.200   1.339  1.00  0.00           O  
HETATM    4  O   UNL     1       3.437  -3.256  -0.191  1.00  0.00           O  
HETATM    5  C   UNL     1      -7.745  -1.350   0.022  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.010  -1.621   1.163  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.181  -0.629  -1.016  1.00  0.00           C  
HETATM    8  C   UNL     1       6.296  -1.402   0.495  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.710  -1.174   1.272  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.882  -0.176  -0.920  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.798   2.589  -0.176  1.00  0.00           C  
HETATM   12  C   UNL     1       5.888  -0.129   0.330  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.562   3.165   0.052  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.849   0.386  -0.548  1.00  0.00           C  
HETATM   15  N   UNL     1       5.416  -2.455   0.406  1.00  0.00           N  
HETATM   16  N   UNL     1       1.865   2.606   0.175  1.00  0.00           N  
HETATM   17  O   UNL     1      -3.192   0.738  -0.670  1.00  0.00           O  
HETATM   18  C   UNL     1      -3.743   0.036   0.339  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.945   1.239  -0.464  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.135  -0.446   0.228  1.00  0.00           C  
HETATM   21  C   UNL     1       4.015   1.360   0.240  1.00  0.00           C  
HETATM   22  C   UNL     1       2.271  -0.803  -0.631  1.00  0.00           C  
HETATM   23  C   UNL     1       4.190  -2.307  -0.132  1.00  0.00           C  
HETATM   24  C   UNL     1       0.561   2.326  -0.018  1.00  0.00           C  
HETATM   25  C   UNL     1       4.532   0.127  -0.002  1.00  0.00           C  
HETATM   26  C   UNL     1       0.404   0.944  -0.330  1.00  0.00           C  
HETATM   27  C   UNL     1       2.624   1.550   0.045  1.00  0.00           C  
HETATM   28  C   UNL     1       3.756  -0.973  -0.659  1.00  0.00           C  
HETATM   29  C   UNL     1       1.753   0.401  -0.363  1.00  0.00           C  
HETATM   30  H   UNL     1       5.281   3.030  -0.164  1.00  0.00           H  
HETATM   31  H   UNL     1       4.314   3.175   1.323  1.00  0.00           H  
HETATM   32  H   UNL     1       5.728   2.093   1.281  1.00  0.00           H  
HETATM   33  H   UNL     1       1.140  -2.486   0.034  1.00  0.00           H  
HETATM   34  H   UNL     1       0.439  -1.624  -1.356  1.00  0.00           H  
HETATM   35  H   UNL     1       1.862  -2.669  -1.582  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.761  -1.706  -0.060  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.456  -2.183   1.970  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.760  -0.421  -1.904  1.00  0.00           H  
HETATM   39  H   UNL     1       7.338  -1.600   0.696  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.138  -1.386   2.163  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.444   0.386  -1.731  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.680   3.211  -0.128  1.00  0.00           H  
HETATM   43  H   UNL     1       6.585   0.687   0.451  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.465   4.217   0.275  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.967  -0.664  -0.772  1.00  0.00           H  
HETATM   46  H   UNL     1       5.685  -3.326   0.740  1.00  0.00           H  
HETATM   47  H   UNL     1       4.047  -0.952  -1.709  1.00  0.00           H  
CONECT    1   21   30   31   32                                       
CONECT    2   22   33   34   35                                       
CONECT    3   18   18                                                 
CONECT    4   23   23                                                 
CONECT    5    6    6    7   36                                       
CONECT    6    5    5    9   37                                       
CONECT    7    5   10   10   38                                       
CONECT    8   12   12   15   39                                       
CONECT    9    6   20   20   40                                       
CONECT   10    7    7   20   41                                       
CONECT   11   13   13   19   42                                       
CONECT   12    8    8   25   43                                       
CONECT   13   11   11   24   44                                       
CONECT   14   19   19   26   45                                       
CONECT   15    8   23   46                                            
CONECT   16   24   27   27                                            
CONECT   17   18   19                                                 
CONECT   18    3    3   17   20                                       
CONECT   19   11   14   14   17                                       
CONECT   20    9    9   10   18                                       
CONECT   21    1   25   25   27                                       
CONECT   22    2   28   29   29                                       
CONECT   23    4    4   15   28                                       
CONECT   24   13   16   26   26                                       
CONECT   25   12   21   21   28                                       
CONECT   26   14   24   24   29                                       
CONECT   27   16   16   21   29                                       
CONECT   28   22   23   25   47                                       
CONECT   29   22   22   26   27                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   28                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
