COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.071  -0.294  -0.130  1.00  0.00           C  
HETATM    2  C   UNL     1       3.946   1.084   0.063  1.00  0.00           C  
HETATM    3  C   UNL     1       2.678   1.620   0.179  1.00  0.00           C  
HETATM    4  N   UNL     1       1.626   0.818   0.104  1.00  0.00           N  
HETATM    5  N   UNL     1       2.973  -1.039  -0.196  1.00  0.00           N  
HETATM    6  C   UNL     1       6.745  -2.992  -0.027  1.00  0.00           C  
HETATM    7  C   UNL     1       6.445  -2.802  -1.515  1.00  0.00           C  
HETATM    8  C   UNL     1       5.442  -2.320  -0.465  1.00  0.00           C  
HETATM    9  N   UNL     1       5.323  -0.875  -0.257  1.00  0.00           N  
HETATM   10  C   UNL     1       5.166   1.965   0.144  1.00  0.00           C  
HETATM   11  F   UNL     1       5.967   1.554   1.215  1.00  0.00           F  
HETATM   12  F   UNL     1       5.892   1.865  -1.047  1.00  0.00           F  
HETATM   13  F   UNL     1       4.770   3.292   0.340  1.00  0.00           F  
HETATM   14  C   UNL     1       1.775  -0.486  -0.080  1.00  0.00           C  
HETATM   15  N   UNL     1       0.649  -1.290  -0.153  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.616  -0.738   0.045  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.609  -1.484   0.685  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.861  -0.940   0.882  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.341  -2.746   1.113  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.402  -3.451   1.760  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.884   0.553  -0.390  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.135   1.104  -0.196  1.00  0.00           C  
HETATM   23  F   UNL     1      -2.394   2.360  -0.620  1.00  0.00           F  
HETATM   24  C   UNL     1      -3.135   0.359   0.440  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.472   0.943   0.648  1.00  0.00           C  
HETATM   26  O   UNL     1      -4.585   2.025   1.191  1.00  0.00           O  
HETATM   27  N   UNL     1      -5.570   0.278   0.236  1.00  0.00           N  
HETATM   28  C   UNL     1      -6.919   0.775   0.549  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.734   0.814  -0.748  1.00  0.00           C  
HETATM   30  O   UNL     1      -7.661  -0.462  -1.389  1.00  0.00           O  
HETATM   31  C   UNL     1      -6.341  -0.842  -1.786  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.455  -0.963  -0.546  1.00  0.00           C  
HETATM   33  H   UNL     1       2.546   2.681   0.329  1.00  0.00           H  
HETATM   34  H   UNL     1       6.679  -4.003   0.375  1.00  0.00           H  
HETATM   35  H   UNL     1       7.513  -2.359   0.417  1.00  0.00           H  
HETATM   36  H   UNL     1       7.016  -2.044  -2.051  1.00  0.00           H  
HETATM   37  H   UNL     1       6.182  -3.689  -2.092  1.00  0.00           H  
HETATM   38  H   UNL     1       4.519  -2.889  -0.351  1.00  0.00           H  
HETATM   39  H   UNL     1       6.120  -0.325  -0.208  1.00  0.00           H  
HETATM   40  H   UNL     1       0.742  -2.237  -0.341  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.629  -1.516   1.376  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.056  -4.443   2.051  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.716  -2.901   2.647  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.245  -3.547   1.075  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.113   1.128  -0.881  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.399   0.107   1.265  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.852   1.778   0.971  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.774   1.047  -0.519  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.327   1.578  -1.411  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.379  -1.801  -2.303  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.929  -0.085  -2.453  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.418  -1.113  -0.849  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.786  -1.805   0.061  1.00  0.00           H  
CONECT    1    2    9    5    5                                       
CONECT    2   10    3    3    1                                       
CONECT    3    2    2    4   33                                       
CONECT    4    3   14   14                                            
CONECT    5    1    1   14                                            
CONECT    6    7    8   34   35                                       
CONECT    7    6    8   36   37                                       
CONECT    8    9    7    6   38                                       
CONECT    9    1    8   39                                            
CONECT   10   12   11   13    2                                       
CONECT   11   10                                                      
CONECT   12   10                                                      
CONECT   13   10                                                      
CONECT   14    4    4    5   15                                       
CONECT   15   14   16   40                                            
CONECT   16   15   17   17   21                                       
CONECT   17   19   16   16   18                                       
CONECT   18   17   24   24   41                                       
CONECT   19   20   17                                                 
CONECT   20   19   42   43   44                                       
CONECT   21   16   22   22   45                                       
CONECT   22   21   21   24   23                                       
CONECT   23   22                                                      
CONECT   24   18   18   22   25                                       
CONECT   25   24   27   26   26                                       
CONECT   26   25   25                                                 
CONECT   27   32   25   28                                            
CONECT   28   27   29   46   47                                       
CONECT   29   30   28   48   49                                       
CONECT   30   31   29                                                 
CONECT   31   32   30   50   51                                       
CONECT   32   31   27   52   53                                       
CONECT   33    3                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   15                                                      
CONECT   41   18                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   28                                                      
CONECT   47   28                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   31                                                      
CONECT   51   31                                                      
CONECT   52   32                                                      
CONECT   53   32                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
