COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.320  -1.820  -1.959  1.00  0.00           C  
HETATM    2  C   UNL     1       1.065  -2.426  -2.970  1.00  0.00           C  
HETATM    3  C   UNL     1       1.560  -3.718  -2.793  1.00  0.00           C  
HETATM    4  C   UNL     1       2.336  -4.350  -3.848  1.00  0.00           C  
HETATM    5  N   UNL     1       2.284  -5.752  -3.867  1.00  0.00           N  
HETATM    6  C   UNL     1       2.953  -6.647  -4.739  1.00  0.00           C  
HETATM    7  C   UNL     1       3.310  -7.913  -4.304  1.00  0.00           C  
HETATM    8  C   UNL     1       3.968  -8.776  -5.181  1.00  0.00           C  
HETATM    9  C   UNL     1       4.260  -8.361  -6.480  1.00  0.00           C  
HETATM   10  C   UNL     1       3.894  -7.083  -6.903  1.00  0.00           C  
HETATM   11  C   UNL     1       3.236  -6.220  -6.027  1.00  0.00           C  
HETATM   12  C   UNL     1       4.207  -6.640  -8.293  1.00  0.00           C  
HETATM   13  F   UNL     1       4.851  -7.587  -9.037  1.00  0.00           F  
HETATM   14  F   UNL     1       3.101  -6.306  -9.022  1.00  0.00           F  
HETATM   15  F   UNL     1       5.012  -5.539  -8.324  1.00  0.00           F  
HETATM   16  O   UNL     1       3.016  -3.686  -4.642  1.00  0.00           O  
HETATM   17  C   UNL     1       1.309  -4.404  -1.604  1.00  0.00           C  
HETATM   18  C   UNL     1       0.564  -3.799  -0.590  1.00  0.00           C  
HETATM   19  C   UNL     1       0.070  -2.506  -0.770  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.731  -1.823   0.292  1.00  0.00           C  
HETATM   21  N   UNL     1       3.027  -8.352  -3.008  1.00  0.00           N  
HETATM   22  C   UNL     1       3.323  -9.596  -2.431  1.00  0.00           C  
HETATM   23  C   UNL     1       2.840  -9.659  -0.995  1.00  0.00           C  
HETATM   24  N   UNL     1       2.508 -11.018  -0.648  1.00  0.00           N  
HETATM   25  C   UNL     1       1.447 -11.546  -1.517  1.00  0.00           C  
HETATM   26  C   UNL     1       2.091 -11.122   0.758  1.00  0.00           C  
HETATM   27  C   UNL     1       1.105 -12.951  -1.157  1.00  0.00           C  
HETATM   28  C   UNL     1       3.177 -10.672   1.676  1.00  0.00           C  
HETATM   29  N   UNL     1      -2.398  -7.557   3.258  1.00  0.00           N  
HETATM   30  C   UNL     1      -2.153  -6.869   2.127  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.044  -6.047   1.943  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.153  -5.957   3.025  1.00  0.00           C  
HETATM   33  N   UNL     1      -0.368  -6.631   4.168  1.00  0.00           N  
HETATM   34  C   UNL     1      -1.478  -7.394   4.223  1.00  0.00           C  
HETATM   35  C   UNL     1      -0.810  -5.337   0.752  1.00  0.00           C  
HETATM   36  C   UNL     1       0.318  -4.532   0.633  1.00  0.00           C  
HETATM   37  C   UNL     1       1.208  -4.435   1.697  1.00  0.00           C  
HETATM   38  C   UNL     1       0.968  -5.144   2.878  1.00  0.00           C  
HETATM   39  N   UNL     1      -1.697  -8.099   5.427  1.00  0.00           N  
HETATM   40  C   UNL     1      -0.804  -8.026   6.541  1.00  0.00           C  
HETATM   41  O   UNL     1       3.903 -10.535  -2.967  1.00  0.00           O  
HETATM   42  H   UNL     1      -0.060  -0.812  -2.107  1.00  0.00           H  
HETATM   43  H   UNL     1       1.254  -1.883  -3.892  1.00  0.00           H  
HETATM   44  H   UNL     1       1.689  -6.182  -3.163  1.00  0.00           H  
HETATM   45  H   UNL     1       4.258  -9.775  -4.863  1.00  0.00           H  
HETATM   46  H   UNL     1       4.773  -9.040  -7.156  1.00  0.00           H  
HETATM   47  H   UNL     1       2.953  -5.224  -6.359  1.00  0.00           H  
HETATM   48  H   UNL     1       1.698  -5.412  -1.472  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.533  -2.481   0.643  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.102  -1.549   1.147  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.179  -0.896  -0.087  1.00  0.00           H  
HETATM   52  H   UNL     1       2.542  -7.683  -2.400  1.00  0.00           H  
HETATM   53  H   UNL     1       1.956  -9.025  -0.874  1.00  0.00           H  
HETATM   54  H   UNL     1       3.632  -9.290  -0.336  1.00  0.00           H  
HETATM   55  H   UNL     1       0.572 -10.898  -1.407  1.00  0.00           H  
HETATM   56  H   UNL     1       1.801 -11.485  -2.550  1.00  0.00           H  
HETATM   57  H   UNL     1       1.198 -10.503   0.888  1.00  0.00           H  
HETATM   58  H   UNL     1       1.828 -12.166   0.951  1.00  0.00           H  
HETATM   59  H   UNL     1       1.973 -13.608  -1.282  1.00  0.00           H  
HETATM   60  H   UNL     1       0.751 -13.014  -0.122  1.00  0.00           H  
HETATM   61  H   UNL     1       0.306 -13.319  -1.811  1.00  0.00           H  
HETATM   62  H   UNL     1       4.069 -11.298   1.563  1.00  0.00           H  
HETATM   63  H   UNL     1       3.443  -9.627   1.483  1.00  0.00           H  
HETATM   64  H   UNL     1       2.839 -10.749   2.716  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.897  -7.000   1.347  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.513  -5.420  -0.075  1.00  0.00           H  
HETATM   67  H   UNL     1       2.096  -3.812   1.627  1.00  0.00           H  
HETATM   68  H   UNL     1       1.680  -5.051   3.696  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.519  -8.669   5.475  1.00  0.00           H  
HETATM   70  H   UNL     1      -0.345  -7.035   6.590  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.014  -8.776   6.442  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.346  -8.209   7.472  1.00  0.00           H  
CONECT    1    2   19   19   42                                       
CONECT    2    1    3    3   43                                       
CONECT    3    2    2    4   17                                       
CONECT    4    3   16   16    5                                       
CONECT    5    4    6   44                                            
CONECT    6    5   11   11    7                                       
CONECT    7    6    8    8   21                                       
CONECT    8    7    7    9   45                                       
CONECT    9    8   10   10   46                                       
CONECT   10    9    9   12   11                                       
CONECT   11    6    6   10   47                                       
CONECT   12   10   15   14   13                                       
CONECT   13   12                                                      
CONECT   14   12                                                      
CONECT   15   12                                                      
CONECT   16    4    4                                                 
CONECT   17    3   18   18   48                                       
CONECT   18   17   17   19   36                                       
CONECT   19    1    1   18   20                                       
CONECT   20   19   49   50   51                                       
CONECT   21    7   22   52                                            
CONECT   22   21   41   41   23                                       
CONECT   23   22   24   53   54                                       
CONECT   24   23   26   25                                            
CONECT   25   24   27   55   56                                       
CONECT   26   24   28   57   58                                       
CONECT   27   25   59   60   61                                       
CONECT   28   26   62   63   64                                       
CONECT   29   30   30   34                                            
CONECT   30   29   29   31   65                                       
CONECT   31   30   35   35   32                                       
CONECT   32   31   33   38   38                                       
CONECT   33   32   34   34                                            
CONECT   34   29   33   33   39                                       
CONECT   35   31   31   36   66                                       
CONECT   36   18   35   37   37                                       
CONECT   37   36   36   38   67                                       
CONECT   38   32   32   37   68                                       
CONECT   39   34   40   69                                            
CONECT   40   39   70   71   72                                       
CONECT   41   22   22                                                 
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    5                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   11                                                      
CONECT   48   17                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   23                                                      
CONECT   54   23                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   30                                                      
CONECT   66   35                                                      
CONECT   67   37                                                      
CONECT   68   38                                                      
CONECT   69   39                                                      
CONECT   70   40                                                      
CONECT   71   40                                                      
CONECT   72   40                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
