COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.720  -0.880  -0.860  1.00  0.00           O  
HETATM    2  C   UNL     1      -0.145   0.141  -0.538  1.00  0.00           C  
HETATM    3  N   UNL     1      -0.741   1.227  -0.015  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.109   1.360   0.242  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.587   2.487   0.899  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.939   2.616   1.150  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.816   1.625   0.750  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.343   0.502   0.096  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.304  -0.572  -0.345  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.082  -1.883   0.365  1.00  0.00           C  
HETATM   11  N   UNL     1      -4.842  -3.036  -0.197  1.00  0.00           N  
HETATM   12  N   UNL     1      -4.705  -3.939   0.709  1.00  0.00           N  
HETATM   13  C   UNL     1      -4.851  -3.402   1.890  1.00  0.00           C  
HETATM   14  N   UNL     1      -5.090  -2.081   1.705  1.00  0.00           N  
HETATM   15  C   UNL     1      -5.314  -1.073   2.744  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.414  -0.711  -1.873  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.537   0.338  -1.808  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.710   0.040  -2.744  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.773  -0.118  -0.356  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.994   0.370  -0.165  1.00  0.00           C  
HETATM   21  C   UNL     1       0.281   2.248   0.241  1.00  0.00           C  
HETATM   22  C   UNL     1       1.595   1.649  -0.193  1.00  0.00           C  
HETATM   23  C   UNL     1       2.888   2.117  -0.198  1.00  0.00           C  
HETATM   24  C   UNL     1       3.190   3.503   0.312  1.00  0.00           C  
HETATM   25  F   UNL     1       2.489   4.443  -0.450  1.00  0.00           F  
HETATM   26  F   UNL     1       2.800   3.603   1.651  1.00  0.00           F  
HETATM   27  F   UNL     1       4.564   3.749   0.207  1.00  0.00           F  
HETATM   28  C   UNL     1       3.913   1.314  -0.670  1.00  0.00           C  
HETATM   29  C   UNL     1       3.640   0.041  -1.139  1.00  0.00           C  
HETATM   30  C   UNL     1       4.760  -0.826  -1.651  1.00  0.00           C  
HETATM   31  N   UNL     1       5.313  -1.617  -0.544  1.00  0.00           N  
HETATM   32  C   UNL     1       6.236  -2.645  -1.041  1.00  0.00           C  
HETATM   33  C   UNL     1       6.678  -3.540   0.119  1.00  0.00           C  
HETATM   34  C   UNL     1       7.657  -4.598  -0.396  1.00  0.00           C  
HETATM   35  C   UNL     1       7.366  -2.683   1.185  1.00  0.00           C  
HETATM   36  C   UNL     1       6.400  -1.590   1.651  1.00  0.00           C  
HETATM   37  C   UNL     1       5.966  -0.752   0.447  1.00  0.00           C  
HETATM   38  C   UNL     1       2.346  -0.438  -1.138  1.00  0.00           C  
HETATM   39  C   UNL     1       1.309   0.363  -0.659  1.00  0.00           C  
HETATM   40  H   UNL     1      -1.902   3.261   1.212  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.311   3.492   1.661  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.872   1.728   0.948  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.789  -3.915   2.838  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.385  -0.944   2.901  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.847  -1.399   3.674  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.876  -0.125   2.431  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.528  -0.369  -2.408  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.752  -1.694  -2.199  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.181   1.365  -1.889  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.149  -0.923  -2.481  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.463   0.821  -2.644  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.354   0.008  -3.773  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.484  -0.940  -0.267  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.983   0.702   0.331  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.625  -0.508  -0.676  1.00  0.00           H  
HETATM   56  H   UNL     1       0.068   3.145  -0.340  1.00  0.00           H  
HETATM   57  H   UNL     1       0.311   2.489   1.304  1.00  0.00           H  
HETATM   58  H   UNL     1       4.928   1.682  -0.673  1.00  0.00           H  
HETATM   59  H   UNL     1       4.378  -1.496  -2.421  1.00  0.00           H  
HETATM   60  H   UNL     1       5.543  -0.196  -2.074  1.00  0.00           H  
HETATM   61  H   UNL     1       5.734  -3.250  -1.796  1.00  0.00           H  
HETATM   62  H   UNL     1       7.110  -2.166  -1.483  1.00  0.00           H  
HETATM   63  H   UNL     1       5.807  -4.031   0.553  1.00  0.00           H  
HETATM   64  H   UNL     1       8.529  -4.106  -0.828  1.00  0.00           H  
HETATM   65  H   UNL     1       7.971  -5.235   0.431  1.00  0.00           H  
HETATM   66  H   UNL     1       7.168  -5.205  -1.157  1.00  0.00           H  
HETATM   67  H   UNL     1       7.644  -3.309   2.033  1.00  0.00           H  
HETATM   68  H   UNL     1       8.259  -2.223   0.762  1.00  0.00           H  
HETATM   69  H   UNL     1       5.524  -2.050   2.109  1.00  0.00           H  
HETATM   70  H   UNL     1       6.898  -0.950   2.379  1.00  0.00           H  
HETATM   71  H   UNL     1       6.841  -0.281  -0.002  1.00  0.00           H  
HETATM   72  H   UNL     1       5.267   0.018   0.773  1.00  0.00           H  
HETATM   73  H   UNL     1       2.135  -1.429  -1.514  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1   39    3                                       
CONECT    3    2    4   21                                            
CONECT    4   20    3    5    5                                       
CONECT    5    4    4    6   40                                       
CONECT    6    7    7    5   41                                       
CONECT    7    8    6    6   42                                       
CONECT    8    9   20   20    7                                       
CONECT    9   16   19   10    8                                       
CONECT   10   11   11    9   14                                       
CONECT   11   10   10   12                                            
CONECT   12   11   13   13                                            
CONECT   13   12   12   14   43                                       
CONECT   14   10   13   15                                            
CONECT   15   14   44   45   46                                       
CONECT   16   17    9   47   48                                       
CONECT   17   18   16   19   49                                       
CONECT   18   17   50   51   52                                       
CONECT   19   17    9   53   54                                       
CONECT   20    8    8    4   55                                       
CONECT   21    3   22   56   57                                       
CONECT   22   39   21   23   23                                       
CONECT   23   22   22   28   24                                       
CONECT   24   23   27   26   25                                       
CONECT   25   24                                                      
CONECT   26   24                                                      
CONECT   27   24                                                      
CONECT   28   29   29   23   58                                       
CONECT   29   38   30   28   28                                       
CONECT   30   31   29   59   60                                       
CONECT   31   32   30   37                                            
CONECT   32   33   31   61   62                                       
CONECT   33   34   32   35   63                                       
CONECT   34   33   64   65   66                                       
CONECT   35   33   36   67   68                                       
CONECT   36   35   37   69   70                                       
CONECT   37   31   36   71   72                                       
CONECT   38   39   39   29   73                                       
CONECT   39    2   38   38   22                                       
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   28                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   32                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
CONECT   68   35                                                      
CONECT   69   36                                                      
CONECT   70   36                                                      
CONECT   71   37                                                      
CONECT   72   37                                                      
CONECT   73   38                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
