COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.332   0.870   0.304  1.00  0.00           C  
HETATM    2  N   UNL     1       7.493  -0.330   0.266  1.00  0.00           N  
HETATM    3  C   UNL     1       8.074  -1.640   0.572  1.00  0.00           C  
HETATM    4  C   UNL     1       4.248   1.115  -0.675  1.00  0.00           C  
HETATM    5  C   UNL     1       5.587   1.015  -0.351  1.00  0.00           C  
HETATM    6  C   UNL     1       6.139  -0.226  -0.061  1.00  0.00           C  
HETATM    7  C   UNL     1       5.342  -1.363  -0.098  1.00  0.00           C  
HETATM    8  C   UNL     1       4.004  -1.256  -0.422  1.00  0.00           C  
HETATM    9  C   UNL     1       3.456  -0.018  -0.705  1.00  0.00           C  
HETATM   10  C   UNL     1       1.995   0.094  -1.059  1.00  0.00           C  
HETATM   11  C   UNL     1       1.177   0.307   0.216  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.247   0.417  -0.128  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.065   0.623   1.074  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.635  -0.301   0.261  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.281  -0.394   0.626  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.516   0.731   0.681  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.054   1.980   0.381  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.362   2.109   0.023  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.179   0.970  -0.044  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.537   1.065  -0.411  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.275  -0.079  -0.458  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.677  -1.309  -0.144  1.00  0.00           C  
HETATM   23  N   UNL     1      -7.441  -2.465  -0.196  1.00  0.00           N  
HETATM   24  N   UNL     1      -5.409  -1.390   0.203  1.00  0.00           N  
HETATM   25  H   UNL     1       7.936   1.567   1.042  1.00  0.00           H  
HETATM   26  H   UNL     1       9.351   0.593   0.576  1.00  0.00           H  
HETATM   27  H   UNL     1       8.334   1.343  -0.678  1.00  0.00           H  
HETATM   28  H   UNL     1       8.448  -2.095  -0.345  1.00  0.00           H  
HETATM   29  H   UNL     1       8.895  -1.518   1.278  1.00  0.00           H  
HETATM   30  H   UNL     1       7.310  -2.283   1.011  1.00  0.00           H  
HETATM   31  H   UNL     1       3.818   2.079  -0.901  1.00  0.00           H  
HETATM   32  H   UNL     1       6.204   1.901  -0.324  1.00  0.00           H  
HETATM   33  H   UNL     1       5.769  -2.330   0.123  1.00  0.00           H  
HETATM   34  H   UNL     1       3.384  -2.140  -0.451  1.00  0.00           H  
HETATM   35  H   UNL     1       1.849   0.940  -1.730  1.00  0.00           H  
HETATM   36  H   UNL     1       1.669  -0.822  -1.551  1.00  0.00           H  
HETATM   37  H   UNL     1       1.324  -0.538   0.888  1.00  0.00           H  
HETATM   38  H   UNL     1       1.503   1.224   0.709  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.400   1.154  -0.801  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.934  -0.221   1.752  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.754   1.541   1.572  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.849  -1.355   0.863  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.427   2.857   0.433  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.768   3.083  -0.207  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.981   2.020  -0.649  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.318  -0.040  -0.735  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.377  -2.418  -0.447  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.039  -3.322   0.019  1.00  0.00           H  
CONECT    1    2   25   26   27                                       
CONECT    2    3    6    1                                            
CONECT    3    2   28   29   30                                       
CONECT    4    9    9    5   31                                       
CONECT    5    6    6    4   32                                       
CONECT    6    7    2    5    5                                       
CONECT    7    8    8    6   33                                       
CONECT    8    7    7    9   34                                       
CONECT    9    8   10    4    4                                       
CONECT   10    9   11   35   36                                       
CONECT   11   10   12   37   38                                       
CONECT   12   11   13   39                                            
CONECT   13   12   16   40   41                                       
CONECT   14   15   24   24   19                                       
CONECT   15   16   16   14   42                                       
CONECT   16   13   15   15   17                                       
CONECT   17   16   18   18   43                                       
CONECT   18   17   17   19   44                                       
CONECT   19   14   18   20   20                                       
CONECT   20   19   19   21   45                                       
CONECT   21   22   22   20   46                                       
CONECT   22   24   23   21   21                                       
CONECT   23   22   47   48                                            
CONECT   24   14   14   22                                            
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
