COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.241  -1.288   1.112  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.500  -1.604   2.244  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.409  -0.833   2.595  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.681  -2.215  -0.539  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.708   3.172  -0.920  1.00  0.00           C  
HETATM    6  C   UNL     1       1.467   1.076   0.616  1.00  0.00           C  
HETATM    7  C   UNL     1       2.348   0.832   1.661  1.00  0.00           C  
HETATM    8  C   UNL     1       3.687   1.142   1.522  1.00  0.00           C  
HETATM    9  C   UNL     1       3.271   1.941  -0.706  1.00  0.00           C  
HETATM   10  C   UNL     1       7.688   1.255  -0.264  1.00  0.00           C  
HETATM   11  O   UNL     1       5.235  -3.029  -0.074  1.00  0.00           O  
HETATM   12  C   UNL     1       6.401  -2.753  -0.276  1.00  0.00           C  
HETATM   13  N   UNL     1       7.295  -3.735  -0.507  1.00  0.00           N  
HETATM   14  C   UNL     1       6.861  -5.134  -0.514  1.00  0.00           C  
HETATM   15  C   UNL     1       6.840  -1.338  -0.269  1.00  0.00           C  
HETATM   16  N   UNL     1       8.117  -1.044  -0.486  1.00  0.00           N  
HETATM   17  C   UNL     1       8.552   0.198  -0.488  1.00  0.00           C  
HETATM   18  C   UNL     1       5.912  -0.330  -0.030  1.00  0.00           C  
HETATM   19  C   UNL     1       6.341   0.995  -0.026  1.00  0.00           C  
HETATM   20  O   UNL     1       5.468   2.008   0.204  1.00  0.00           O  
HETATM   21  C   UNL     1       4.151   1.697   0.338  1.00  0.00           C  
HETATM   22  C   UNL     1       1.933   1.626  -0.571  1.00  0.00           C  
HETATM   23  N   UNL     1       0.110   0.762   0.757  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.854   1.580   0.187  1.00  0.00           C  
HETATM   25  N   UNL     1      -0.472   2.666  -0.467  1.00  0.00           N  
HETATM   26  C   UNL     1      -1.363   3.474  -1.026  1.00  0.00           C  
HETATM   27  F   UNL     1      -3.642   3.973  -1.478  1.00  0.00           F  
HETATM   28  N   UNL     1      -2.132   1.253   0.307  1.00  0.00           N  
HETATM   29  C   UNL     1      -3.079   2.015  -0.228  1.00  0.00           C  
HETATM   30  N   UNL     1      -4.417   1.669  -0.100  1.00  0.00           N  
HETATM   31  C   UNL     1      -4.783   0.573   0.685  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.880  -0.200   0.330  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.050   0.255   1.822  1.00  0.00           C  
HETATM   34  N   UNL     1      -7.346  -2.069   0.758  1.00  0.00           N  
HETATM   35  O   UNL     1      -6.973  -1.744  -1.405  1.00  0.00           O  
HETATM   36  C   UNL     1      -8.934  -2.963  -0.915  1.00  0.00           C  
HETATM   37  C   UNL     1      -9.079  -2.982  -2.438  1.00  0.00           C  
HETATM   38  H   UNL     1      -5.777  -2.453   2.851  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.834  -1.080   3.476  1.00  0.00           H  
HETATM   40  H   UNL     1       1.987   0.401   2.583  1.00  0.00           H  
HETATM   41  H   UNL     1       4.372   0.953   2.334  1.00  0.00           H  
HETATM   42  H   UNL     1       3.632   2.378  -1.626  1.00  0.00           H  
HETATM   43  H   UNL     1       8.056   2.270  -0.268  1.00  0.00           H  
HETATM   44  H   UNL     1       8.226  -3.515  -0.668  1.00  0.00           H  
HETATM   45  H   UNL     1       6.107  -5.277  -1.289  1.00  0.00           H  
HETATM   46  H   UNL     1       7.716  -5.779  -0.716  1.00  0.00           H  
HETATM   47  H   UNL     1       6.436  -5.388   0.457  1.00  0.00           H  
HETATM   48  H   UNL     1       9.598   0.395  -0.669  1.00  0.00           H  
HETATM   49  H   UNL     1       4.874  -0.571   0.147  1.00  0.00           H  
HETATM   50  H   UNL     1       1.248   1.816  -1.384  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.157  -0.027   1.253  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.042   4.357  -1.558  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.098   2.189  -0.555  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.452   0.045  -0.553  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.197   0.857   2.099  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.871  -2.507   1.446  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.872  -3.985  -0.543  1.00  0.00           H  
HETATM   58  H   UNL     1      -9.799  -2.467  -0.474  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.986  -3.523  -2.710  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.141  -1.959  -2.810  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.214  -3.477  -2.879  1.00  0.00           H  
CONECT    1    2   34   32   32                                       
CONECT    2    3    3    1   38                                       
CONECT    3    2    2   33   39                                       
CONECT    4   35   35   36   34                                       
CONECT    5   26   26   29   27                                       
CONECT    6   22   22    7   23                                       
CONECT    7    8    8    6   40                                       
CONECT    8   21    7    7   41                                       
CONECT    9   21   21   22   42                                       
CONECT   10   19   19   17   43                                       
CONECT   11   12   12                                                 
CONECT   12   11   11   13   15                                       
CONECT   13   14   12   44                                            
CONECT   14   13   45   46   47                                       
CONECT   15   12   18   18   16                                       
CONECT   16   15   17   17                                            
CONECT   17   16   16   10   48                                       
CONECT   18   15   15   19   49                                       
CONECT   19   18   20   10   10                                       
CONECT   20   19   21                                                 
CONECT   21   20    9    9    8                                       
CONECT   22    9    6    6   50                                       
CONECT   23    6   24   51                                            
CONECT   24   23   25   25   28                                       
CONECT   25   24   24   26                                            
CONECT   26   25    5    5   52                                       
CONECT   27    5                                                      
CONECT   28   24   29   29                                            
CONECT   29   28   28    5   30                                       
CONECT   30   29   31   53                                            
CONECT   31   33   33   32   30                                       
CONECT   32    1    1   31   54                                       
CONECT   33    3   31   31   55                                       
CONECT   34    4    1   56                                            
CONECT   35    4    4                                                 
CONECT   36   37    4   57   58                                       
CONECT   37   36   59   60   61                                       
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   14                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   26                                                      
CONECT   53   30                                                      
CONECT   54   32                                                      
CONECT   55   33                                                      
CONECT   56   34                                                      
CONECT   57   36                                                      
CONECT   58   36                                                      
CONECT   59   37                                                      
CONECT   60   37                                                      
CONECT   61   37                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
