COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.303  -0.548  -0.488  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.643   1.263   0.585  1.00  0.00           C  
HETATM    3  C   UNL     1       4.521   0.098  -0.055  1.00  0.00           C  
HETATM    4  C   UNL     1       3.884   0.547  -1.170  1.00  0.00           C  
HETATM    5  C   UNL     1       0.216   0.258  -1.349  1.00  0.00           C  
HETATM    6  C   UNL     1       5.985   0.140   0.186  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.340  -3.465  -0.493  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.991   1.340  -0.062  1.00  0.00           C  
HETATM    9  C   UNL     1       6.836   0.680  -0.776  1.00  0.00           C  
HETATM   10  C   UNL     1       7.875  -0.314   1.595  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.678  -0.203   0.408  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.640  -1.004  -0.068  1.00  0.00           C  
HETATM   13  C   UNL     1       2.397  -0.255   0.249  1.00  0.00           C  
HETATM   14  N   UNL     1       3.598  -0.385   0.794  1.00  0.00           N  
HETATM   15  N   UNL     1       2.546   0.322  -0.987  1.00  0.00           N  
HETATM   16  C   UNL     1       1.112  -0.600   0.706  1.00  0.00           C  
HETATM   17  N   UNL     1      -4.096  -2.284  -0.069  1.00  0.00           N  
HETATM   18  N   UNL     1      -5.413  -2.279   0.404  1.00  0.00           N  
HETATM   19  C   UNL     1      -5.761  -1.052   0.692  1.00  0.00           C  
HETATM   20  C   UNL     1       0.027  -0.337  -0.084  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.255  -0.671   0.350  1.00  0.00           N  
HETATM   22  C   UNL     1       1.456   0.573  -1.772  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.741   2.000   0.322  1.00  0.00           N  
HETATM   24  O   UNL     1      -2.145  -0.066  -1.594  1.00  0.00           O  
HETATM   25  O   UNL     1      -3.625   1.805   0.969  1.00  0.00           O  
HETATM   26  C   UNL     1      -5.683   3.460   0.421  1.00  0.00           C  
HETATM   27  C   UNL     1       6.512  -0.356   1.376  1.00  0.00           C  
HETATM   28  C   UNL     1       8.197   0.717  -0.547  1.00  0.00           C  
HETATM   29  C   UNL     1       8.716   0.219   0.635  1.00  0.00           C  
HETATM   30  H   UNL     1       4.346   0.997  -2.037  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.636   0.462  -1.981  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.879  -3.933   0.377  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.013  -4.175  -0.973  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.564  -3.166  -1.198  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.592   1.153   0.828  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.545   1.983  -0.746  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.766   0.394  -0.554  1.00  0.00           H  
HETATM   38  H   UNL     1       6.432   1.069  -1.699  1.00  0.00           H  
HETATM   39  H   UNL     1       8.285  -0.702   2.516  1.00  0.00           H  
HETATM   40  H   UNL     1       0.982  -1.056   1.677  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.720  -0.743   1.081  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.392  -0.992   1.255  1.00  0.00           H  
HETATM   43  H   UNL     1       1.590   1.028  -2.743  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.394   3.878  -0.544  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.663   3.844   0.704  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.949   3.745   1.175  1.00  0.00           H  
HETATM   47  H   UNL     1       5.857  -0.772   2.127  1.00  0.00           H  
HETATM   48  H   UNL     1       8.858   1.136  -1.291  1.00  0.00           H  
HETATM   49  H   UNL     1       9.781   0.250   0.810  1.00  0.00           H  
CONECT    1   12   21   24   24                                       
CONECT    2   11   23   25   25                                       
CONECT    3   14    4    4    6                                       
CONECT    4   15    3    3   30                                       
CONECT    5   20   22   22   31                                       
CONECT    6    3   27   27    9                                       
CONECT    7   17   32   33   34                                       
CONECT    8   23   35   36   37                                       
CONECT    9    6   28   28   38                                       
CONECT   10   27   29   29   39                                       
CONECT   11    2   12   12   19                                       
CONECT   12   11   11    1   17                                       
CONECT   13   15   14   14   16                                       
CONECT   14   13   13    3                                            
CONECT   15   13    4   22                                            
CONECT   16   13   20   20   40                                       
CONECT   17   12   18    7                                            
CONECT   18   17   19   19                                            
CONECT   19   11   18   18   41                                       
CONECT   20   16   16    5   21                                       
CONECT   21    1   20   42                                            
CONECT   22   15    5    5   43                                       
CONECT   23    2   26    8                                            
CONECT   24    1    1                                                 
CONECT   25    2    2                                                 
CONECT   26   23   44   45   46                                       
CONECT   27    6    6   10   47                                       
CONECT   28    9    9   29   48                                       
CONECT   29   28   10   10   49                                       
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   16                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   26                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   29                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
