COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.429   1.747   0.341  1.00  0.00           C  
HETATM    2  C   UNL     1       0.678  -0.643  -0.854  1.00  0.00           C  
HETATM    3  C   UNL     1       5.619  -1.959  -0.539  1.00  0.00           C  
HETATM    4  C   UNL     1       3.885  -3.040   1.268  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.459  -0.710  -0.324  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.283   1.285   0.798  1.00  0.00           C  
HETATM    7  C   UNL     1       0.096   1.403   0.270  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.202   0.530   0.312  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.375  -1.466  -0.810  1.00  0.00           C  
HETATM   10  C   UNL     1       4.917   0.370   0.065  1.00  0.00           C  
HETATM   11  C   UNL     1       6.644   3.536  -0.162  1.00  0.00           C  
HETATM   12  N   UNL     1       5.717   2.403  -0.105  1.00  0.00           N  
HETATM   13  C   UNL     1       6.061   1.112   0.071  1.00  0.00           C  
HETATM   14  C   UNL     1       4.824  -1.100   0.227  1.00  0.00           C  
HETATM   15  C   UNL     1       5.497  -3.321  -0.361  1.00  0.00           C  
HETATM   16  N   UNL     1       4.649  -3.815   0.522  1.00  0.00           N  
HETATM   17  C   UNL     1       3.940  -1.667   1.150  1.00  0.00           C  
HETATM   18  N   UNL     1       4.324   2.480  -0.216  1.00  0.00           N  
HETATM   19  C   UNL     1       3.832   1.264  -0.118  1.00  0.00           C  
HETATM   20  C   UNL     1       2.397   0.894  -0.188  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.283   0.208  -0.326  1.00  0.00           C  
HETATM   22  C   UNL     1       2.014  -0.307  -0.782  1.00  0.00           C  
HETATM   23  O   UNL     1      -1.598  -0.126  -0.399  1.00  0.00           O  
HETATM   24  C   UNL     1      -2.534   0.796   0.164  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.932   0.261  -0.009  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.115  -0.965  -0.645  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.782  -1.163  -0.453  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.803  -0.403   0.031  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.553   0.818   0.652  1.00  0.00           C  
HETATM   30  N   UNL     1      -4.944   0.962   0.442  1.00  0.00           N  
HETATM   31  H   UNL     1       1.724   2.679   0.801  1.00  0.00           H  
HETATM   32  H   UNL     1       0.380  -1.574  -1.314  1.00  0.00           H  
HETATM   33  H   UNL     1       6.314  -1.562  -1.263  1.00  0.00           H  
HETATM   34  H   UNL     1       3.204  -3.487   1.977  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.106   2.232   1.286  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.654   2.063   0.680  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.536  -2.415  -1.300  1.00  0.00           H  
HETATM   38  H   UNL     1       6.955   3.700  -1.194  1.00  0.00           H  
HETATM   39  H   UNL     1       6.148   4.431   0.215  1.00  0.00           H  
HETATM   40  H   UNL     1       7.519   3.321   0.451  1.00  0.00           H  
HETATM   41  H   UNL     1       7.065   0.732   0.194  1.00  0.00           H  
HETATM   42  H   UNL     1       6.103  -3.992  -0.951  1.00  0.00           H  
HETATM   43  H   UNL     1       3.311  -1.039   1.763  1.00  0.00           H  
HETATM   44  H   UNL     1       2.761  -0.970  -1.192  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.323   0.925   1.225  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.447   1.757  -0.344  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.262  -1.520  -1.006  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.988  -2.108  -0.933  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.820  -0.752  -0.069  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.380   1.402   1.028  1.00  0.00           H  
CONECT    1    7    7   20   31                                       
CONECT    2   21   21   22   32                                       
CONECT    3   14   14   15   33                                       
CONECT    4   17   17   16   34                                       
CONECT    5   27   27    9    8                                       
CONECT    6   29    8    8   35                                       
CONECT    7    1    1   21   36                                       
CONECT    8    5    6    6   30                                       
CONECT    9    5   26   26   37                                       
CONECT   10   19   14   13   13                                       
CONECT   11   12   38   39   40                                       
CONECT   12   11   18   13                                            
CONECT   13   10   10   12   41                                       
CONECT   14    3    3   10   17                                       
CONECT   15    3   16   16   42                                       
CONECT   16    4   15   15                                            
CONECT   17    4    4   14   43                                       
CONECT   18   12   19   19                                            
CONECT   19   10   18   18   20                                       
CONECT   20    1   19   22   22                                       
CONECT   21    2    2    7   23                                       
CONECT   22    2   20   20   44                                       
CONECT   23   21   24                                                 
CONECT   24   23   25   45   46                                       
CONECT   25   24   26   30   30                                       
CONECT   26    9    9   25   47                                       
CONECT   27    5    5   28   48                                       
CONECT   28   27   29   29   49                                       
CONECT   29    6   28   28   50                                       
CONECT   30    8   25   25                                            
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   22                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
