COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -2.142   3.330  -0.049  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.394  -0.179  -0.008  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.593   0.412  -0.131  1.00  0.00           C  
HETATM    4  N   UNL     1      -5.435   1.770  -0.203  1.00  0.00           N  
HETATM    5  C   UNL     1       0.191   0.660   0.280  1.00  0.00           C  
HETATM    6  C   UNL     1       1.522   0.029   0.415  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.001  -0.014   0.232  1.00  0.00           N  
HETATM    8  C   UNL     1       2.666   0.726   0.039  1.00  0.00           C  
HETATM    9  C   UNL     1       3.918   0.123   0.170  1.00  0.00           C  
HETATM   10  C   UNL     1       4.014  -1.177   0.678  1.00  0.00           C  
HETATM   11  C   UNL     1       2.874  -1.861   1.049  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.027   1.949   0.187  1.00  0.00           N  
HETATM   13  C   UNL     1       5.135   0.853  -0.225  1.00  0.00           C  
HETATM   14  C   UNL     1       6.343   0.268  -0.097  1.00  0.00           C  
HETATM   15  C   UNL     1       7.525   0.977  -0.482  1.00  0.00           C  
HETATM   16  N   UNL     1       8.464   1.540  -0.787  1.00  0.00           N  
HETATM   17  C   UNL     1       1.633  -1.266   0.926  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.358   2.176   0.076  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.450   3.255  -0.140  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.995   0.923   0.104  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.393   0.887   0.003  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.101   2.094  -0.124  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.181  -1.466   0.304  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.672  -1.800   0.226  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.860  -3.316   0.302  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.127  -3.980  -0.866  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.636  -3.646  -0.788  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.448  -2.130  -0.863  1.00  0.00           C  
HETATM   29  H   UNL     1      -1.664   4.298  -0.067  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.204  -1.240   0.071  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.540  -0.106  -0.169  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.159   2.409  -0.294  1.00  0.00           H  
HETATM   33  H   UNL     1       2.586   1.730  -0.353  1.00  0.00           H  
HETATM   34  H   UNL     1       4.981  -1.648   0.777  1.00  0.00           H  
HETATM   35  H   UNL     1       2.953  -2.864   1.440  1.00  0.00           H  
HETATM   36  H   UNL     1       5.059   1.856  -0.617  1.00  0.00           H  
HETATM   37  H   UNL     1       6.418  -0.735   0.295  1.00  0.00           H  
HETATM   38  H   UNL     1       0.745  -1.808   1.218  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.775  -1.836   1.246  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.195  -1.327   1.058  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.078  -1.430  -0.715  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.454  -3.686   1.243  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.922  -3.554   0.246  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.261  -5.060  -0.812  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.533  -3.610  -1.807  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.230  -4.016   0.154  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.114  -4.119  -1.619  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.854  -1.760  -1.804  1.00  0.00           H  
HETATM   49  H   UNL     1       0.614  -1.892  -0.807  1.00  0.00           H  
CONECT    1   18   19   19   29                                       
CONECT    2   21    3    3   30                                       
CONECT    3    2    2    4   31                                       
CONECT    4   22    3   32                                            
CONECT    5    6    7   12   12                                       
CONECT    6   17   17    8    5                                       
CONECT    7    5   23   20                                            
CONECT    8    9    9    6   33                                       
CONECT    9   10   13    8    8                                       
CONECT   10   11   11    9   34                                       
CONECT   11   10   10   17   35                                       
CONECT   12    5    5   18                                            
CONECT   13   14   14    9   36                                       
CONECT   14   15   13   13   37                                       
CONECT   15   16   16   16   14                                       
CONECT   16   15   15   15                                            
CONECT   17   11    6    6   38                                       
CONECT   18   12   20   20    1                                       
CONECT   19    1    1   22                                            
CONECT   20    7   18   18   21                                       
CONECT   21   20    2   22   22                                       
CONECT   22   21   21   19    4                                       
CONECT   23   28    7   24   39                                       
CONECT   24   23   25   40   41                                       
CONECT   25   26   24   42   43                                       
CONECT   26   27   25   44   45                                       
CONECT   27   28   26   46   47                                       
CONECT   28   27   23   48   49                                       
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   17                                                      
CONECT   39   23                                                      
CONECT   40   24                                                      
CONECT   41   24                                                      
CONECT   42   25                                                      
CONECT   43   25                                                      
CONECT   44   26                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
