COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.835   1.356   2.448  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.490   0.438   1.567  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.200   0.407   1.056  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.280   1.374   1.502  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.699   2.321   2.435  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.991   2.276   2.884  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.550  -0.406   0.146  1.00  0.00           N  
HETATM    8  C   UNL     1       0.741  -0.005  -0.011  1.00  0.00           C  
HETATM    9  C   UNL     1       0.981   1.094   0.799  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.137  -1.490  -0.520  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.355  -2.685   0.153  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.934  -3.751  -0.506  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.296  -3.631  -1.835  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.079  -2.443  -2.509  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.506  -1.370  -1.854  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.502  -0.582   1.112  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.496   0.074   0.188  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.298   0.035  -1.180  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.209   0.637  -2.027  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.318   1.277  -1.507  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.516   1.316  -0.140  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.608   0.709   0.708  1.00  0.00           C  
HETATM   23  O   UNL     1       1.646  -0.588  -0.827  1.00  0.00           O  
HETATM   24  C   UNL     1       2.420  -1.582  -0.316  1.00  0.00           C  
HETATM   25  C   UNL     1       2.206  -2.032   0.978  1.00  0.00           C  
HETATM   26  C   UNL     1       2.994  -3.044   1.496  1.00  0.00           C  
HETATM   27  C   UNL     1       3.996  -3.606   0.722  1.00  0.00           C  
HETATM   28  C   UNL     1       4.209  -3.158  -0.568  1.00  0.00           C  
HETATM   29  C   UNL     1       3.420  -2.151  -1.091  1.00  0.00           C  
HETATM   30  C   UNL     1       3.650  -1.668  -2.500  1.00  0.00           C  
HETATM   31  F   UNL     1       2.788  -3.483   2.757  1.00  0.00           F  
HETATM   32  C   UNL     1       2.239   1.831   0.928  1.00  0.00           C  
HETATM   33  N   UNL     1       2.530   2.825   0.066  1.00  0.00           N  
HETATM   34  O   UNL     1       3.023   1.545   1.815  1.00  0.00           O  
HETATM   35  C   UNL     1       3.809   3.546   0.149  1.00  0.00           C  
HETATM   36  C   UNL     1       4.457   3.550  -1.240  1.00  0.00           C  
HETATM   37  N   UNL     1       3.503   4.087  -2.220  1.00  0.00           N  
HETATM   38  C   UNL     1       2.312   3.234  -2.328  1.00  0.00           C  
HETATM   39  C   UNL     1       1.579   3.213  -0.987  1.00  0.00           C  
HETATM   40  H   UNL     1      -0.017   3.076   2.797  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.327   3.004   3.607  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.072  -2.780   1.191  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.105  -4.681   0.017  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.749  -4.466  -2.349  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.363  -2.351  -3.547  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.341  -0.441  -2.379  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.993  -1.388   0.584  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.024  -0.987   1.978  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.431  -0.465  -1.586  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.055   0.607  -3.096  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.030   1.748  -2.169  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.383   1.817   0.267  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.762   0.739   1.776  1.00  0.00           H  
HETATM   54  H   UNL     1       1.426  -1.592   1.582  1.00  0.00           H  
HETATM   55  H   UNL     1       4.611  -4.396   1.127  1.00  0.00           H  
HETATM   56  H   UNL     1       4.991  -3.598  -1.170  1.00  0.00           H  
HETATM   57  H   UNL     1       4.373  -0.853  -2.491  1.00  0.00           H  
HETATM   58  H   UNL     1       4.034  -2.488  -3.107  1.00  0.00           H  
HETATM   59  H   UNL     1       2.708  -1.315  -2.921  1.00  0.00           H  
HETATM   60  H   UNL     1       3.631   4.571   0.472  1.00  0.00           H  
HETATM   61  H   UNL     1       4.467   3.044   0.858  1.00  0.00           H  
HETATM   62  H   UNL     1       5.351   4.174  -1.223  1.00  0.00           H  
HETATM   63  H   UNL     1       4.729   2.532  -1.518  1.00  0.00           H  
HETATM   64  H   UNL     1       3.248   5.037  -1.993  1.00  0.00           H  
HETATM   65  H   UNL     1       1.651   3.628  -3.099  1.00  0.00           H  
HETATM   66  H   UNL     1       2.614   2.220  -2.591  1.00  0.00           H  
HETATM   67  H   UNL     1       0.764   2.491  -1.028  1.00  0.00           H  
HETATM   68  H   UNL     1       1.183   4.206  -0.775  1.00  0.00           H  
CONECT    1    2    2    6                                            
CONECT    2    1    1   16    3                                       
CONECT    3    2    4    4    7                                       
CONECT    4    3    3    5    9                                       
CONECT    5    4    6    6   40                                       
CONECT    6    1    5    5   41                                       
CONECT    7    3   10    8                                            
CONECT    8    7    9    9   23                                       
CONECT    9    4    8    8   32                                       
CONECT   10    7   11   11   15                                       
CONECT   11   10   10   12   42                                       
CONECT   12   11   13   13   43                                       
CONECT   13   12   12   14   44                                       
CONECT   14   13   15   15   45                                       
CONECT   15   10   14   14   46                                       
CONECT   16    2   17   47   48                                       
CONECT   17   16   22   22   18                                       
CONECT   18   17   19   19   49                                       
CONECT   19   18   18   20   50                                       
CONECT   20   19   21   21   51                                       
CONECT   21   20   20   22   52                                       
CONECT   22   17   17   21   53                                       
CONECT   23    8   24                                                 
CONECT   24   23   29   29   25                                       
CONECT   25   24   26   26   54                                       
CONECT   26   25   25   31   27                                       
CONECT   27   26   28   28   55                                       
CONECT   28   27   27   29   56                                       
CONECT   29   24   24   28   30                                       
CONECT   30   29   57   58   59                                       
CONECT   31   26                                                      
CONECT   32    9   34   34   33                                       
CONECT   33   32   35   39                                            
CONECT   34   32   32                                                 
CONECT   35   33   36   60   61                                       
CONECT   36   35   37   62   63                                       
CONECT   37   36   38   64                                            
CONECT   38   37   39   65   66                                       
CONECT   39   33   38   67   68                                       
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   25                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   35                                                      
CONECT   61   35                                                      
CONECT   62   36                                                      
CONECT   63   36                                                      
CONECT   64   37                                                      
CONECT   65   38                                                      
CONECT   66   38                                                      
CONECT   67   39                                                      
CONECT   68   39                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
