COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -4.787  -3.282  -0.172  1.00  0.00           F  
HETATM    2  C   UNL     1      -3.442  -3.166  -0.118  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.650  -4.305  -0.107  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.862  -1.914  -0.081  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.473  -1.792  -0.025  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.555  -0.644   0.025  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.722   0.747   0.035  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.986   1.307  -0.007  1.00  0.00           N  
HETATM    9  C   UNL     1      -2.089   2.306  -1.102  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.305   3.165  -0.684  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.038   4.675  -0.733  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.151   5.078  -1.831  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.318   4.530   0.616  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.149   3.258   0.856  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.435   3.438   1.666  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.280   2.045   1.241  1.00  0.00           C  
HETATM   17  N   UNL     1       0.362   1.517   0.087  1.00  0.00           N  
HETATM   18  C   UNL     1       1.574   0.983   0.128  1.00  0.00           C  
HETATM   19  N   UNL     1       1.773  -0.323   0.119  1.00  0.00           N  
HETATM   20  C   UNL     1       0.745  -1.170   0.069  1.00  0.00           C  
HETATM   21  N   UNL     1       0.660  -2.540   0.049  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.669  -2.940  -0.008  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.270  -4.199  -0.052  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.480  -5.353  -0.040  1.00  0.00           N  
HETATM   25  C   UNL     1      -1.112  -6.674  -0.085  1.00  0.00           C  
HETATM   26  O   UNL     1       2.648   1.806   0.180  1.00  0.00           O  
HETATM   27  C   UNL     1       3.885   1.247   0.110  1.00  0.00           C  
HETATM   28  C   UNL     1       4.392   0.788  -1.101  1.00  0.00           C  
HETATM   29  N   UNL     1       5.601   0.250  -1.128  1.00  0.00           N  
HETATM   30  C   UNL     1       6.319   0.147  -0.028  1.00  0.00           C  
HETATM   31  C   UNL     1       7.691  -0.473  -0.106  1.00  0.00           C  
HETATM   32  N   UNL     1       5.873   0.570   1.137  1.00  0.00           N  
HETATM   33  C   UNL     1       4.677   1.125   1.246  1.00  0.00           C  
HETATM   34  H   UNL     1      -3.113  -5.280  -0.140  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.482  -1.030  -0.094  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.187   2.915  -1.153  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.276   1.812  -2.056  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.268   2.826  -1.065  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.945   5.279  -0.679  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.001   6.076  -1.827  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.273   4.581  -1.788  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.249   4.339   0.519  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.540   5.335   1.316  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.100   2.593   1.485  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.192   3.489   2.727  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.929   4.361   1.362  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.825   1.402   1.932  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.351   2.384   1.699  1.00  0.00           H  
HETATM   49  H   UNL     1       1.419  -3.143   0.071  1.00  0.00           H  
HETATM   50  H   UNL     1       0.486  -5.279  -0.002  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.766  -6.793   0.779  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.698  -6.765  -1.000  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.343  -7.446  -0.068  1.00  0.00           H  
HETATM   54  H   UNL     1       3.809   0.870  -2.006  1.00  0.00           H  
HETATM   55  H   UNL     1       8.430   0.304  -0.304  1.00  0.00           H  
HETATM   56  H   UNL     1       7.923  -0.962   0.840  1.00  0.00           H  
HETATM   57  H   UNL     1       7.713  -1.208  -0.910  1.00  0.00           H  
HETATM   58  H   UNL     1       4.320   1.474   2.204  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3    4                                       
CONECT    3    2    2   23   34                                       
CONECT    4    2    5    5   35                                       
CONECT    5    4    4   22    6                                       
CONECT    6    5   20   20    7                                       
CONECT    7    6    8   17   17                                       
CONECT    8    9    7   16                                            
CONECT    9    8   10   36   37                                       
CONECT   10    9   14   11   38                                       
CONECT   11   10   12   13   39                                       
CONECT   12   11   40   41                                            
CONECT   13   14   11   42   43                                       
CONECT   14   16   10   15   13                                       
CONECT   15   14   44   45   46                                       
CONECT   16    8   14   47   48                                       
CONECT   17    7    7   18                                            
CONECT   18   19   19   17   26                                       
CONECT   19   20   18   18                                            
CONECT   20   21    6    6   19                                       
CONECT   21   22   20   49                                            
CONECT   22   23   23    5   21                                       
CONECT   23    3   24   22   22                                       
CONECT   24   25   23   50                                            
CONECT   25   24   51   52   53                                       
CONECT   26   18   27                                                 
CONECT   27   26   28   28   33                                       
CONECT   28   27   27   29   54                                       
CONECT   29   28   30   30                                            
CONECT   30   29   29   32   31                                       
CONECT   31   30   55   56   57                                       
CONECT   32   33   33   30                                            
CONECT   33   27   32   32   58                                       
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   21                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   25                                                      
CONECT   53   25                                                      
CONECT   54   28                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   33                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
