COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.277   0.853  -0.053  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.023   1.888   0.058  1.00  0.00           C  
HETATM    3  C   UNL     1       1.008   0.331  -0.098  1.00  0.00           C  
HETATM    4  C   UNL     1       3.354   0.701  -0.119  1.00  0.00           C  
HETATM    5  C   UNL     1       8.151  -0.622   0.097  1.00  0.00           C  
HETATM    6  C   UNL     1       4.532   1.640  -0.090  1.00  0.00           C  
HETATM    7  C   UNL     1       5.809   0.842  -0.024  1.00  0.00           C  
HETATM    8  C   UNL     1       6.442   0.454  -1.190  1.00  0.00           C  
HETATM    9  C   UNL     1       7.613  -0.278  -1.129  1.00  0.00           C  
HETATM   10  C   UNL     1       7.518  -0.233   1.263  1.00  0.00           C  
HETATM   11  C   UNL     1       6.347   0.499   1.202  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.357  -0.020   0.027  1.00  0.00           C  
HETATM   13  C   UNL     1       0.204  -1.833   0.000  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.480   1.955   0.567  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.004   0.545   0.208  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.924   0.058   1.249  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.700   0.563  -1.154  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.215   0.353  -1.176  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.101  -1.391   0.054  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.282  -0.755  -1.668  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.759  -0.312   0.159  1.00  0.00           C  
HETATM   22  O   UNL     1      -3.749  -1.525   0.186  1.00  0.00           O  
HETATM   23  N   UNL     1       2.101   1.194  -0.178  1.00  0.00           N  
HETATM   24  C   UNL     1       0.489  -3.312   0.028  1.00  0.00           C  
HETATM   25  O   UNL     1       3.533  -0.498  -0.089  1.00  0.00           O  
HETATM   26  N   UNL     1       1.207  -0.978  -0.065  1.00  0.00           N  
HETATM   27  N   UNL     1      -2.665   0.465   0.080  1.00  0.00           N  
HETATM   28  N   UNL     1      -6.635  -0.318   2.052  1.00  0.00           N  
HETATM   29  H   UNL     1      -0.435   1.921  -0.076  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.961   2.276  -0.959  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.366   2.454   0.718  1.00  0.00           H  
HETATM   32  H   UNL     1       9.064  -1.197   0.144  1.00  0.00           H  
HETATM   33  H   UNL     1       4.532   2.252  -0.993  1.00  0.00           H  
HETATM   34  H   UNL     1       4.461   2.285   0.785  1.00  0.00           H  
HETATM   35  H   UNL     1       6.022   0.722  -2.148  1.00  0.00           H  
HETATM   36  H   UNL     1       8.108  -0.582  -2.040  1.00  0.00           H  
HETATM   37  H   UNL     1       7.938  -0.501   2.221  1.00  0.00           H  
HETATM   38  H   UNL     1       5.852   0.803   2.113  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.509   2.119   1.644  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.042   2.726   0.041  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.275   1.247  -1.890  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.717   0.202  -0.220  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.788   0.899  -1.926  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.916  -2.098   0.107  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.241  -0.939  -2.741  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.169  -1.635  -1.035  1.00  0.00           H  
HETATM   47  H   UNL     1       1.959   2.148  -0.277  1.00  0.00           H  
HETATM   48  H   UNL     1       0.506  -3.698  -0.991  1.00  0.00           H  
HETATM   49  H   UNL     1       1.457  -3.487   0.498  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.289  -3.822   0.597  1.00  0.00           H  
CONECT    1    3    3   12   29                                       
CONECT    2   27   14   30   31                                       
CONECT    3   26   23    1    1                                       
CONECT    4   23    6   25   25                                       
CONECT    5    9    9   10   32                                       
CONECT    6    7    4   33   34                                       
CONECT    7    8    8   11    6                                       
CONECT    8    9    7    7   35                                       
CONECT    9    5    5    8   36                                       
CONECT   10    5   11   11   37                                       
CONECT   11   10   10    7   38                                       
CONECT   12   19   19    1   27                                       
CONECT   13   24   26   26   19                                       
CONECT   14    2   15   39   40                                       
CONECT   15   21   14   16   17                                       
CONECT   16   15   28   28   28                                       
CONECT   17   15   20   18   41                                       
CONECT   18   17   20   42   43                                       
CONECT   19   13   12   12   44                                       
CONECT   20   17   18   45   46                                       
CONECT   21   22   22   27   15                                       
CONECT   22   21   21                                                 
CONECT   23    3    4   47                                            
CONECT   24   13   48   49   50                                       
CONECT   25    4    4                                                 
CONECT   26   13   13    3                                            
CONECT   27   12   21    2                                            
CONECT   28   16   16   16                                            
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
