COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.746  -0.040   0.491  1.00  0.00           N  
HETATM    2  C   UNL     1       2.422   0.540  -0.384  1.00  0.00           C  
HETATM    3  C   UNL     1       4.653   0.369  -1.308  1.00  0.00           C  
HETATM    4  C   UNL     1       5.485  -1.145   1.017  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.338   2.180   0.446  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.550   3.049  -0.043  1.00  0.00           C  
HETATM    7  O   UNL     1      -6.559  -2.284  -1.154  1.00  0.00           O  
HETATM    8  C   UNL     1      -5.505  -1.567  -0.717  1.00  0.00           C  
HETATM    9  O   UNL     1      -5.517  -0.355  -0.804  1.00  0.00           O  
HETATM   10  C   UNL     1      -4.337  -2.253  -0.132  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.347  -3.637   0.085  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.234  -4.238   0.633  1.00  0.00           C  
HETATM   13  N   UNL     1      -2.167  -3.532   0.955  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.105  -2.231   0.773  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.178  -1.538   0.220  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.110  -0.164   0.029  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.902   0.510   0.230  1.00  0.00           C  
HETATM   18  N   UNL     1       0.234   0.948   0.630  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.704   1.960   0.187  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.042   4.318  -0.015  1.00  0.00           C  
HETATM   21  F   UNL     1      -2.858   5.371  -0.237  1.00  0.00           F  
HETATM   22  C   UNL     1      -0.692   4.533   0.242  1.00  0.00           C  
HETATM   23  C   UNL     1       0.152   3.484   0.470  1.00  0.00           C  
HETATM   24  C   UNL     1       1.648   0.705   0.926  1.00  0.00           C  
HETATM   25  N   UNL     1       3.840   0.296  -0.087  1.00  0.00           N  
HETATM   26  C   UNL     1       6.135   0.255  -0.943  1.00  0.00           C  
HETATM   27  C   UNL     1       6.378  -1.074  -0.224  1.00  0.00           C  
HETATM   28  F   UNL     1       7.721  -1.158   0.161  1.00  0.00           F  
HETATM   29  F   UNL     1       6.070  -2.134  -1.083  1.00  0.00           F  
HETATM   30  C   UNL     1       4.022  -0.991   0.596  1.00  0.00           C  
HETATM   31  H   UNL     1       2.017  -0.304  -0.942  1.00  0.00           H  
HETATM   32  H   UNL     1       2.326   1.448  -0.979  1.00  0.00           H  
HETATM   33  H   UNL     1       4.380  -0.449  -1.975  1.00  0.00           H  
HETATM   34  H   UNL     1       4.474   1.321  -1.808  1.00  0.00           H  
HETATM   35  H   UNL     1       5.622  -2.107   1.510  1.00  0.00           H  
HETATM   36  H   UNL     1       5.752  -0.342   1.705  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.600   2.888  -0.243  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.300  -1.790  -1.530  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.216  -4.225  -0.174  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.236  -5.304   0.803  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.210  -1.695   1.051  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.900   0.327  -0.245  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.307   5.542   0.261  1.00  0.00           H  
HETATM   44  H   UNL     1       1.198   3.664   0.668  1.00  0.00           H  
HETATM   45  H   UNL     1       1.744  -0.203   1.521  1.00  0.00           H  
HETATM   46  H   UNL     1       2.053   1.549   1.484  1.00  0.00           H  
HETATM   47  H   UNL     1       6.737   0.294  -1.851  1.00  0.00           H  
HETATM   48  H   UNL     1       6.412   1.081  -0.287  1.00  0.00           H  
HETATM   49  H   UNL     1       3.751  -1.802  -0.081  1.00  0.00           H  
HETATM   50  H   UNL     1       3.383  -1.026   1.479  1.00  0.00           H  
CONECT    1   18   17   17                                            
CONECT    2   25   24   31   32                                       
CONECT    3   26   25   33   34                                       
CONECT    4   27   30   35   36                                       
CONECT    5   18   23   23   19                                       
CONECT    6   19   19   20   37                                       
CONECT    7    8   38                                                 
CONECT    8   10    9    9    7                                       
CONECT    9    8    8                                                 
CONECT   10   15   15   11    8                                       
CONECT   11   12   12   10   39                                       
CONECT   12   13   11   11   40                                       
CONECT   13   14   14   12                                            
CONECT   14   13   13   15   41                                       
CONECT   15   14   16   10   10                                       
CONECT   16   17   15   42                                            
CONECT   17    1    1   19   16                                       
CONECT   18   24    1    5                                            
CONECT   19    5   17    6    6                                       
CONECT   20   22   22    6   21                                       
CONECT   21   20                                                      
CONECT   22   23   20   20   43                                       
CONECT   23    5    5   22   44                                       
CONECT   24    2   18   45   46                                       
CONECT   25    3   30    2                                            
CONECT   26    3   27   47   48                                       
CONECT   27   28   26    4   29                                       
CONECT   28   27                                                      
CONECT   29   27                                                      
CONECT   30    4   25   49   50                                       
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   30                                                      
CONECT   50   30                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
