COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.892   4.309   1.258  1.00  0.00           C  
HETATM    2  C   UNL     1       2.824  -2.763  -2.668  1.00  0.00           C  
HETATM    3  C   UNL     1       2.229  -2.441  -1.295  1.00  0.00           C  
HETATM    4  C   UNL     1       0.727  -2.388  -1.398  1.00  0.00           C  
HETATM    5  CA  UNL     1      -1.433  -1.519  -0.679  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.943  -0.450   0.253  1.00  0.00           C  
HETATM    7  CA  UNL     1      -3.751   0.890   1.186  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.040   1.489   0.619  1.00  0.00           C  
HETATM    9  C   UNL     1       6.650   3.304   2.176  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.737   2.194  -0.704  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.824   3.420  -0.467  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.374   4.428  -1.500  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.542  -2.168   2.013  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.000   2.782  -1.293  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.034   0.277   2.558  1.00  0.00           C  
HETATM   16  C   UNL     1       6.347   2.028   1.740  1.00  0.00           C  
HETATM   17  C   UNL     1       2.634  -3.528  -0.297  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.116  -2.848  -0.353  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.865  -3.204   1.114  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.359  -3.210   1.387  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.442  -4.590   1.408  1.00  0.00           C  
HETATM   22  C   UNL     1       6.287   1.757   0.386  1.00  0.00           C  
HETATM   23  C   UNL     1       6.530   2.762  -0.532  1.00  0.00           C  
HETATM   24  C   UNL     1       6.833   4.038  -0.096  1.00  0.00           C  
HETATM   25  C   UNL     1       5.958   0.365  -0.090  1.00  0.00           C  
HETATM   26  C   UNL     1       4.057  -0.957  -0.669  1.00  0.00           C  
HETATM   27  N   UNL     1       2.733  -1.145  -0.836  1.00  0.00           N  
HETATM   28  N   UNL     1       0.016  -1.661  -0.514  1.00  0.00           N  
HETATM   29  N   UNL     1      -3.256  -0.149   0.279  1.00  0.00           N  
HETATM   30  N   UNL     1      -5.770   4.034  -1.726  1.00  0.00           N  
HETATM   31  O   UNL     1      -7.065   2.207  -1.366  1.00  0.00           O  
HETATM   32  O   UNL     1      -5.101  -0.668   2.447  1.00  0.00           O  
HETATM   33  O   UNL     1       4.833  -1.863  -0.900  1.00  0.00           O  
HETATM   34  O   UNL     1       0.157  -3.001  -2.276  1.00  0.00           O  
HETATM   35  O   UNL     1      -1.171   0.138   0.980  1.00  0.00           O  
HETATM   36  O   UNL     1       4.521   0.235  -0.247  1.00  0.00           O  
HETATM   37  H   UNL     1       7.124   5.307   1.599  1.00  0.00           H  
HETATM   38  H   UNL     1       2.535  -1.988  -3.379  1.00  0.00           H  
HETATM   39  H   UNL     1       3.910  -2.801  -2.593  1.00  0.00           H  
HETATM   40  H   UNL     1       2.449  -3.727  -3.009  1.00  0.00           H  
HETATM   41  HA  UNL     1      -1.656  -1.239  -1.709  1.00  0.00           H  
HETATM   42  HA  UNL     1      -3.000   1.674   1.285  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.766   0.694   0.449  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.450   2.208   1.329  1.00  0.00           H  
HETATM   45  H   UNL     1       6.697   3.516   3.234  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.272   1.503  -1.406  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.937   3.800   0.548  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.782   3.176  -0.676  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.328   5.441  -1.100  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.808   4.363  -2.429  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.531  -1.936   1.618  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.638  -2.570   3.022  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.939  -1.261   2.040  1.00  0.00           H  
HETATM   54  H1  UNL     1      -3.139  -0.227   2.922  1.00  0.00           H  
HETATM   55  H2  UNL     1      -4.318   1.064   3.257  1.00  0.00           H  
HETATM   56  H   UNL     1       6.158   1.243   2.457  1.00  0.00           H  
HETATM   57  H   UNL     1       3.721  -3.567  -0.222  1.00  0.00           H  
HETATM   58  H   UNL     1       2.210  -3.299   0.681  1.00  0.00           H  
HETATM   59  H   UNL     1       2.259  -4.493  -0.639  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.188  -2.758  -0.527  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.709  -3.632  -0.992  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.157  -3.780   2.294  1.00  0.00           H  
HETATM   63  H   UNL     1       0.160  -3.670   0.546  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.009  -2.186   1.515  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.515  -4.586   1.214  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.960  -5.328   0.767  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.263  -4.844   2.453  1.00  0.00           H  
HETATM   68  H   UNL     1       6.483   2.550  -1.590  1.00  0.00           H  
HETATM   69  H   UNL     1       7.018   4.824  -0.813  1.00  0.00           H  
HETATM   70  H   UNL     1       6.446   0.184  -1.048  1.00  0.00           H  
HETATM   71  H   UNL     1       6.311  -0.362   0.641  1.00  0.00           H  
HETATM   72  H   UNL     1       2.114  -0.421  -0.652  1.00  0.00           H  
HETATM   73  H   UNL     1       0.463  -1.230   0.231  1.00  0.00           H  
HETATM   74  H   UNL     1      -3.873  -0.619  -0.303  1.00  0.00           H  
HETATM   75  H   UNL     1      -6.440   4.603  -2.134  1.00  0.00           H  
HETATM   76  H   UNL     1      -5.334  -1.097   3.282  1.00  0.00           H  
CONECT    1    9   24   24   37                                       
CONECT    2    3   38   39   40                                       
CONECT    3   27    2    4   17                                       
CONECT    4   34   34    3   28                                       
CONECT    5   28    6   18   41                                       
CONECT    6   29    5   35   35                                       
CONECT    7    8   29   15   42                                       
CONECT    8   10    7   43   44                                       
CONECT    9   16   16    1   45                                       
CONECT   10   14   11    8   46                                       
CONECT   11   12   10   47   48                                       
CONECT   12   30   11   49   50                                       
CONECT   13   19   51   52   53                                       
CONECT   14   30   31   31   10                                       
CONECT   15    7   32   54   55                                       
CONECT   16    9    9   22   56                                       
CONECT   17    3   57   58   59                                       
CONECT   18    5   19   60   61                                       
CONECT   19   13   20   18   21                                       
CONECT   20   19   62   63   64                                       
CONECT   21   19   65   66   67                                       
CONECT   22   16   25   23   23                                       
CONECT   23   22   22   24   68                                       
CONECT   24    1    1   23   69                                       
CONECT   25   22   36   70   71                                       
CONECT   26   36   27   33   33                                       
CONECT   27   26    3   72                                            
CONECT   28    4    5   73                                            
CONECT   29    7    6   74                                            
CONECT   30   14   12   75                                            
CONECT   31   14   14                                                 
CONECT   32   15   76                                                 
CONECT   33   26   26                                                 
CONECT   34    4    4                                                 
CONECT   35    6    6                                                 
CONECT   36   25   26                                                 
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    5                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   13                                                      
CONECT   54   15                                                      
CONECT   55   15                                                      
CONECT   56   16                                                      
CONECT   57   17                                                      
CONECT   58   17                                                      
CONECT   59   17                                                      
CONECT   60   18                                                      
CONECT   61   18                                                      
CONECT   62   20                                                      
CONECT   63   20                                                      
CONECT   64   20                                                      
CONECT   65   21                                                      
CONECT   66   21                                                      
CONECT   67   21                                                      
CONECT   68   23                                                      
CONECT   69   24                                                      
CONECT   70   25                                                      
CONECT   71   25                                                      
CONECT   72   27                                                      
CONECT   73   28                                                      
CONECT   74   29                                                      
CONECT   75   30                                                      
CONECT   76   32                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
