COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.496   0.803   0.363  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.946  -0.379  -0.089  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.518   1.635   0.495  1.00  0.00           C  
HETATM    4  C   UNL     1       1.097  -1.551  -0.169  1.00  0.00           C  
HETATM    5  N   UNL     1       3.062   0.863  -0.316  1.00  0.00           N  
HETATM    6  C   UNL     1      -6.869   1.610   0.161  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.756  -1.569  -0.066  1.00  0.00           C  
HETATM    8  C   UNL     1       4.052   1.843  -0.420  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.807   3.593   0.963  1.00  0.00           C  
HETATM   10  C   UNL     1       5.550  -2.891   1.653  1.00  0.00           C  
HETATM   11  C   UNL     1       3.940   2.877  -1.347  1.00  0.00           C  
HETATM   12  C   UNL     1       2.505  -1.515   0.259  1.00  0.00           C  
HETATM   13  C   UNL     1       3.381  -0.401   0.184  1.00  0.00           C  
HETATM   14  N   UNL     1       4.541  -0.769   0.666  1.00  0.00           N  
HETATM   15  N   UNL     1      -5.660   0.976   0.119  1.00  0.00           N  
HETATM   16  C   UNL     1      -5.296  -0.289  -0.247  1.00  0.00           C  
HETATM   17  N   UNL     1       4.461  -2.109   1.063  1.00  0.00           N  
HETATM   18  C   UNL     1       3.222  -2.557   0.813  1.00  0.00           C  
HETATM   19  N   UNL     1       0.382  -2.686  -0.037  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.115  -1.576  -0.369  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.596   2.975   0.927  1.00  0.00           C  
HETATM   22  O   UNL     1       0.579  -0.557  -0.640  1.00  0.00           O  
HETATM   23  C   UNL     1      -0.985  -2.690  -0.335  1.00  0.00           C  
HETATM   24  N   UNL     1       6.092   2.759   0.270  1.00  0.00           N  
HETATM   25  N   UNL     1       4.899   3.785  -1.414  1.00  0.00           N  
HETATM   26  C   UNL     1      -6.959   2.892   0.572  1.00  0.00           C  
HETATM   27  C   UNL     1       5.949   3.721  -0.620  1.00  0.00           C  
HETATM   28  C   UNL     1       5.175   1.816   0.404  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.694  -2.710  -0.936  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.920  -3.824  -1.195  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.570  -3.816  -0.900  1.00  0.00           C  
HETATM   32  H   UNL     1       2.153   1.061  -0.590  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.761   1.080  -0.138  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.304  -0.693   0.373  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.882   4.620   1.292  1.00  0.00           H  
HETATM   36  H   UNL     1       5.523  -2.789   2.738  1.00  0.00           H  
HETATM   37  H   UNL     1       5.431  -3.940   1.384  1.00  0.00           H  
HETATM   38  H   UNL     1       6.505  -2.525   1.277  1.00  0.00           H  
HETATM   39  H   UNL     1       3.083   2.936  -2.001  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.954  -1.071  -0.596  1.00  0.00           H  
HETATM   41  H   UNL     1       2.851  -3.552   1.011  1.00  0.00           H  
HETATM   42  H   UNL     1       0.815  -3.500   0.264  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.704   3.504   1.226  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.922   3.381   0.599  1.00  0.00           H  
HETATM   45  H   UNL     1       6.716   4.477  -0.703  1.00  0.00           H  
HETATM   46  H   UNL     1       5.297   1.033   1.138  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.747  -2.718  -1.172  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.370  -4.702  -1.634  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.968  -4.688  -1.109  1.00  0.00           H  
CONECT    1    3    3    2                                            
CONECT    2    1   20   16   16                                       
CONECT    3    1    1   15   21                                       
CONECT    4   12   19   22   22                                       
CONECT    5   13    8   32                                            
CONECT    6   15   26   26   33                                       
CONECT    7   20   23   23   34                                       
CONECT    8    5   11   28   28                                       
CONECT    9   21   21   26   35                                       
CONECT   10   17   36   37   38                                       
CONECT   11   25   25    8   39                                       
CONECT   12   13   18   18    4                                       
CONECT   13   12   14   14    5                                       
CONECT   14   13   13   17                                            
CONECT   15   16    3    6                                            
CONECT   16    2    2   15   40                                       
CONECT   17   14   10   18                                            
CONECT   18   12   12   17   41                                       
CONECT   19    4   23   42                                            
CONECT   20    2   29   29    7                                       
CONECT   21    3    9    9   43                                       
CONECT   22    4    4                                                 
CONECT   23   19   31    7    7                                       
CONECT   24   27   27   28                                            
CONECT   25   27   11   11                                            
CONECT   26    6    6    9   44                                       
CONECT   27   24   24   25   45                                       
CONECT   28   24    8    8   46                                       
CONECT   29   20   20   30   47                                       
CONECT   30   29   31   31   48                                       
CONECT   31   23   30   30   49                                       
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   16                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   21                                                      
CONECT   44   26                                                      
CONECT   45   27                                                      
CONECT   46   28                                                      
CONECT   47   29                                                      
CONECT   48   30                                                      
CONECT   49   31                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
