COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.479   1.161  -1.223  1.00  0.00           O  
HETATM    2  C   UNL     1       2.633   1.090  -0.856  1.00  0.00           C  
HETATM    3  N   UNL     1       3.467   2.121  -0.641  1.00  0.00           N  
HETATM    4  C   UNL     1       4.732   1.700  -0.224  1.00  0.00           C  
HETATM    5  C   UNL     1       5.873   2.430   0.102  1.00  0.00           C  
HETATM    6  C   UNL     1       7.024   1.779   0.495  1.00  0.00           C  
HETATM    7  C   UNL     1       7.055   0.397   0.568  1.00  0.00           C  
HETATM    8  F   UNL     1       8.185  -0.236   0.953  1.00  0.00           F  
HETATM    9  C   UNL     1       5.923  -0.336   0.245  1.00  0.00           C  
HETATM   10  C   UNL     1       4.774   0.314  -0.146  1.00  0.00           C  
HETATM   11  C   UNL     1       3.403  -0.177  -0.548  1.00  0.00           C  
HETATM   12  C   UNL     1       2.747  -0.938   0.606  1.00  0.00           C  
HETATM   13  C   UNL     1       1.436  -1.521   0.142  1.00  0.00           C  
HETATM   14  C   UNL     1       0.273  -0.787   0.263  1.00  0.00           C  
HETATM   15  C   UNL     1       1.401  -2.789  -0.409  1.00  0.00           C  
HETATM   16  C   UNL     1       0.201  -3.328  -0.835  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.966  -2.601  -0.713  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.934  -1.325  -0.165  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.113  -0.584  -0.044  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.281  -1.210   0.202  1.00  0.00           C  
HETATM   21  O   UNL     1      -3.295  -2.408   0.414  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.542  -0.444   0.214  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.753  -1.092   0.468  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.928  -0.373   0.478  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.909   0.996   0.235  1.00  0.00           C  
HETATM   26  O   UNL     1      -8.069   1.701   0.246  1.00  0.00           O  
HETATM   27  C   UNL     1      -7.978   3.103  -0.011  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.706   1.644  -0.018  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.527   0.933  -0.024  1.00  0.00           C  
HETATM   30  H   UNL     1       3.220   3.051  -0.763  1.00  0.00           H  
HETATM   31  H   UNL     1       5.856   3.509   0.046  1.00  0.00           H  
HETATM   32  H   UNL     1       7.905   2.350   0.746  1.00  0.00           H  
HETATM   33  H   UNL     1       5.943  -1.414   0.301  1.00  0.00           H  
HETATM   34  H   UNL     1       3.468  -0.808  -1.435  1.00  0.00           H  
HETATM   35  H   UNL     1       3.406  -1.742   0.933  1.00  0.00           H  
HETATM   36  H   UNL     1       2.567  -0.255   1.436  1.00  0.00           H  
HETATM   37  H   UNL     1       0.302   0.205   0.689  1.00  0.00           H  
HETATM   38  H   UNL     1       2.313  -3.360  -0.506  1.00  0.00           H  
HETATM   39  H   UNL     1       0.177  -4.318  -1.265  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.903  -3.022  -1.046  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.091   0.382  -0.137  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.769  -2.155   0.657  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.865  -0.873   0.675  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.973   3.545   0.027  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.344   3.571   0.742  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.546   3.264  -0.999  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.696   2.707  -0.207  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.592   1.438  -0.221  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2   11    3    1    1                                       
CONECT    3    4    2   30                                            
CONECT    4    5    5   10    3                                       
CONECT    5    6    4    4   31                                       
CONECT    6    7    7    5   32                                       
CONECT    7    8    6    6    9                                       
CONECT    8    7                                                      
CONECT    9    7   10   10   33                                       
CONECT   10    9    9    4   11                                       
CONECT   11   10   12    2   34                                       
CONECT   12   13   11   35   36                                       
CONECT   13   14   12   15   15                                       
CONECT   14   18   18   13   37                                       
CONECT   15   13   13   16   38                                       
CONECT   16   17   17   15   39                                       
CONECT   17   18   16   16   40                                       
CONECT   18   19   14   14   17                                       
CONECT   19   20   18   41                                            
CONECT   20   22   21   21   19                                       
CONECT   21   20   20                                                 
CONECT   22   23   23   29   20                                       
CONECT   23   24   22   22   42                                       
CONECT   24   25   25   23   43                                       
CONECT   25   26   24   24   28                                       
CONECT   26   27   25                                                 
CONECT   27   26   44   45   46                                       
CONECT   28   25   29   29   47                                       
CONECT   29   28   28   22   48                                       
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    9                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   19                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   27                                                      
CONECT   45   27                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   29                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
