COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.349   1.343  -0.720  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.577   0.673  -0.674  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.866   0.875  -1.329  1.00  0.00           C  
HETATM    4  N   UNL     1      -8.674  -0.059  -0.915  1.00  0.00           N  
HETATM    5  N   UNL     1      -8.015  -0.897  -0.009  1.00  0.00           N  
HETATM    6  C   UNL     1      -6.724  -0.460   0.149  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.645  -0.902   0.910  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.453  -0.240   0.857  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.294   0.879   0.039  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.061   1.543  -0.002  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.887   0.829   0.135  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.724   1.469   0.203  1.00  0.00           N  
HETATM   13  N   UNL     1      -1.921  -0.498   0.204  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.792  -1.185   0.335  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.827  -2.536   0.405  1.00  0.00           O  
HETATM   16  C   UNL     1      -2.112  -3.157   0.332  1.00  0.00           C  
HETATM   17  N   UNL     1       0.370  -0.548   0.397  1.00  0.00           N  
HETATM   18  C   UNL     1       0.405   0.780   0.334  1.00  0.00           C  
HETATM   19  N   UNL     1       1.614   1.443   0.398  1.00  0.00           N  
HETATM   20  C   UNL     1       2.859   0.683   0.535  1.00  0.00           C  
HETATM   21  C   UNL     1       4.044   1.651   0.582  1.00  0.00           C  
HETATM   22  C   UNL     1       5.325   0.869   0.724  1.00  0.00           C  
HETATM   23  C   UNL     1       6.109   0.277  -0.363  1.00  0.00           C  
HETATM   24  C   UNL     1       5.964   0.231  -1.751  1.00  0.00           C  
HETATM   25  C   UNL     1       6.895  -0.421  -2.509  1.00  0.00           C  
HETATM   26  C   UNL     1       7.985  -1.039  -1.910  1.00  0.00           C  
HETATM   27  C   UNL     1       8.147  -1.005  -0.542  1.00  0.00           C  
HETATM   28  C   UNL     1       7.211  -0.347   0.249  1.00  0.00           C  
HETATM   29  N   UNL     1       7.093  -0.142   1.605  1.00  0.00           N  
HETATM   30  C   UNL     1       5.967   0.589   1.869  1.00  0.00           C  
HETATM   31  H   UNL     1      -5.227   2.213  -1.349  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.107   1.660  -2.031  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.752  -1.770   1.544  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.621  -0.590   1.451  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.033   2.505  -0.126  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.586  -2.900  -0.616  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.998  -4.238   0.400  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.733  -2.804   1.156  1.00  0.00           H  
HETATM   39  H   UNL     1       1.640   2.411   0.352  1.00  0.00           H  
HETATM   40  H   UNL     1       2.830   0.100   1.456  1.00  0.00           H  
HETATM   41  H   UNL     1       2.972   0.013  -0.316  1.00  0.00           H  
HETATM   42  H   UNL     1       4.074   2.234  -0.338  1.00  0.00           H  
HETATM   43  H   UNL     1       3.932   2.321   1.434  1.00  0.00           H  
HETATM   44  H   UNL     1       5.119   0.709  -2.223  1.00  0.00           H  
HETATM   45  H   UNL     1       6.782  -0.456  -3.582  1.00  0.00           H  
HETATM   46  H   UNL     1       8.712  -1.550  -2.522  1.00  0.00           H  
HETATM   47  H   UNL     1       8.998  -1.489  -0.086  1.00  0.00           H  
HETATM   48  H   UNL     1       7.718  -0.464   2.274  1.00  0.00           H  
HETATM   49  H   UNL     1       5.642   0.893   2.853  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.408  -1.665   0.435  1.00  0.00           H  
CONECT    1    9    9    2   31                                       
CONECT    2    1    3    6    6                                       
CONECT    3    2    4    4   32                                       
CONECT    4    3    3    5                                            
CONECT    5    6    4   50                                            
CONECT    6    2    2    7    5                                       
CONECT    7    8    8    6   33                                       
CONECT    8    9    7    7   34                                       
CONECT    9   10    1    1    8                                       
CONECT   10   11    9   35                                            
CONECT   11   13   13   12   10                                       
CONECT   12   18   18   11                                            
CONECT   13   14   11   11                                            
CONECT   14   15   17   17   13                                       
CONECT   15   16   14                                                 
CONECT   16   15   36   37   38                                       
CONECT   17   14   14   18                                            
CONECT   18   17   19   12   12                                       
CONECT   19   20   18   39                                            
CONECT   20   19   21   40   41                                       
CONECT   21   20   22   42   43                                       
CONECT   22   21   30   30   23                                       
CONECT   23   22   24   28   28                                       
CONECT   24   23   25   25   44                                       
CONECT   25   24   24   26   45                                       
CONECT   26   25   27   27   46                                       
CONECT   27   28   26   26   47                                       
CONECT   28   23   23   29   27                                       
CONECT   29   30   28   48                                            
CONECT   30   22   22   29   49                                       
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
CONECT   48   29                                                      
CONECT   49   30                                                      
CONECT   50    5                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
