COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.724   3.932   1.439  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.438   3.472   0.008  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.476   2.312   0.035  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.942   0.997   0.109  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.347   0.728   0.160  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.011  -0.060   0.132  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.862  -2.063   1.348  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.491  -3.452   1.483  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.251  -4.243   0.194  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.842  -3.468  -0.988  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.203  -2.079  -1.051  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.230   1.413   0.009  1.00  0.00           C  
HETATM   13  C   UNL     1       1.075  -0.052  -0.152  1.00  0.00           C  
HETATM   14  C   UNL     1       2.574  -0.098  -0.008  1.00  0.00           C  
HETATM   15  C   UNL     1       3.147  -0.778   1.051  1.00  0.00           C  
HETATM   16  C   UNL     1       4.522  -0.820   1.183  1.00  0.00           C  
HETATM   17  C   UNL     1       5.325  -0.182   0.257  1.00  0.00           C  
HETATM   18  C   UNL     1       6.825  -0.227   0.401  1.00  0.00           C  
HETATM   19  C   UNL     1       4.753   0.497  -0.803  1.00  0.00           C  
HETATM   20  C   UNL     1       3.378   0.535  -0.938  1.00  0.00           C  
HETATM   21  C   UNL     1       0.680  -0.638  -1.483  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.096   2.524  -0.018  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.569   3.853  -0.100  1.00  0.00           C  
HETATM   24  F   UNL     1       7.326  -1.341  -0.280  1.00  0.00           F  
HETATM   25  F   UNL     1       7.380   0.938  -0.138  1.00  0.00           F  
HETATM   26  F   UNL     1       7.160  -0.319   1.756  1.00  0.00           F  
HETATM   27  N   UNL     1      -6.462   0.514   0.200  1.00  0.00           N  
HETATM   28  N   UNL     1      -3.461  -1.363   0.205  1.00  0.00           N  
HETATM   29  N   UNL     1      -3.903  -5.556   0.295  1.00  0.00           N  
HETATM   30  N   UNL     1      -1.711   0.181   0.084  1.00  0.00           N  
HETATM   31  N   UNL     1       0.582   0.157  -2.567  1.00  0.00           N  
HETATM   32  N   UNL     1      -1.151   4.907  -0.164  1.00  0.00           N  
HETATM   33  O   UNL     1       0.451  -1.825  -1.579  1.00  0.00           O  
HETATM   34  S   UNL     1       0.512   1.665  -0.058  1.00  0.00           S  
HETATM   35  H   UNL     1      -5.163   3.109   2.003  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.793   4.242   1.914  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.419   4.771   1.419  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.368   3.162  -0.467  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.999   4.295  -0.557  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.043  -1.493   2.259  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.788  -2.165   1.190  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.035  -3.978   2.322  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.562  -3.352   1.655  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.180  -4.377   0.042  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.637  -4.006  -1.914  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.919  -3.368  -0.855  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.128  -2.180  -1.198  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.632  -1.520  -1.883  1.00  0.00           H  
HETATM   49  H   UNL     1       0.615  -0.630   0.650  1.00  0.00           H  
HETATM   50  H   UNL     1       2.519  -1.276   1.775  1.00  0.00           H  
HETATM   51  H   UNL     1       4.969  -1.350   2.011  1.00  0.00           H  
HETATM   52  H   UNL     1       5.380   0.996  -1.527  1.00  0.00           H  
HETATM   53  H   UNL     1       2.931   1.065  -1.766  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.759  -6.097  -0.544  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.580  -6.058   1.109  1.00  0.00           H  
HETATM   56  H   UNL     1       0.258  -0.205  -3.406  1.00  0.00           H  
HETATM   57  H   UNL     1       0.835   1.092  -2.507  1.00  0.00           H  
CONECT    1    2   35   36   37                                       
CONECT    2    3    1   38   39                                       
CONECT    3   22    2    4    4                                       
CONECT    4    3    3    6    5                                       
CONECT    5    4   27   27   27                                       
CONECT    6   30   30    4   28                                       
CONECT    7    8   28   40   41                                       
CONECT    8    9    7   42   43                                       
CONECT    9    8   10   29   44                                       
CONECT   10    9   11   45   46                                       
CONECT   11   10   28   47   48                                       
CONECT   12   34   22   22   30                                       
CONECT   13   14   21   34   49                                       
CONECT   14   20   20   15   13                                       
CONECT   15   16   16   14   50                                       
CONECT   16   17   15   15   51                                       
CONECT   17   18   19   19   16                                       
CONECT   18   26   25   24   17                                       
CONECT   19   17   17   20   52                                       
CONECT   20   19   14   14   53                                       
CONECT   21   31   33   33   13                                       
CONECT   22   23   12   12    3                                       
CONECT   23   32   32   32   22                                       
CONECT   24   18                                                      
CONECT   25   18                                                      
CONECT   26   18                                                      
CONECT   27    5    5    5                                            
CONECT   28    6    7   11                                            
CONECT   29    9   54   55                                            
CONECT   30   12    6    6                                            
CONECT   31   21   56   57                                            
CONECT   32   23   23   23                                            
CONECT   33   21   21                                                 
CONECT   34   13   12                                                 
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   13                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
