COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.763  -0.023  -0.976  1.00  0.00           C  
HETATM    2  C   UNL     1      -9.687   0.233   1.390  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.566   0.565   2.470  1.00  0.00           C  
HETATM    4  CG2 UNL     1      -1.363   2.609  -0.960  1.00  0.00           C  
HETATM    5  CG1 UNL     1      -0.296   1.480  -2.917  1.00  0.00           C  
HETATM    6  CG  UNL     1       2.388  -3.095   1.094  1.00  0.00           C  
HETATM    7  CD2 UNL     1       2.266  -4.611   1.261  1.00  0.00           C  
HETATM    8  CA  UNL     1       5.277  -0.595  -0.702  1.00  0.00           C  
HETATM    9  C   UNL     1       2.862  -0.902  -0.816  1.00  0.00           C  
HETATM   10  CA  UNL     1       1.524  -1.111  -0.155  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.695  -0.172  -0.516  1.00  0.00           C  
HETATM   12  CA  UNL     1      -1.838   0.200  -1.425  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.266   0.080  -1.257  1.00  0.00           C  
HETATM   14  CA  UNL     1      -5.511   0.147  -0.477  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.677   0.118   0.096  1.00  0.00           C  
HETATM   16  C   UNL     1      -9.073   0.048   0.185  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.939   0.491   2.532  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.917   0.380   1.253  1.00  0.00           C  
HETATM   19  CB  UNL     1      -1.561   1.564  -2.060  1.00  0.00           C  
HETATM   20  CB  UNL     1       1.317  -2.602   0.118  1.00  0.00           C  
HETATM   21  CD1 UNL     1       2.193  -2.415   2.450  1.00  0.00           C  
HETATM   22  C   UNL     1       5.889  -1.883  -1.190  1.00  0.00           C  
HETATM   23  C   UNL     1       6.211   0.060   0.317  1.00  0.00           C  
HETATM   24  C   UNL     1       5.638   1.415   0.737  1.00  0.00           C  
HETATM   25  C   UNL     1       5.626   2.392  -0.462  1.00  0.00           C  
HETATM   26  C   UNL     1       5.967   3.734   0.222  1.00  0.00           C  
HETATM   27  C   UNL     1       6.541   2.080   1.752  1.00  0.00           C  
HETATM   28  N   UNL     1       0.462  -0.624  -1.039  1.00  0.00           N  
HETATM   29  N   UNL     1      -3.079   0.267  -0.648  1.00  0.00           N  
HETATM   30  N   UNL     1      -5.594   0.393   0.880  1.00  0.00           N  
HETATM   31  N   UNL     1       3.985  -0.877  -0.071  1.00  0.00           N  
HETATM   32  N   UNL     1       6.714   3.377   1.434  1.00  0.00           N  
HETATM   33  O   UNL     1       2.928  -0.756  -2.018  1.00  0.00           O  
HETATM   34  O   UNL     1      -4.308  -0.144  -2.452  1.00  0.00           O  
HETATM   35  O   UNL     1      -0.817  -0.065   0.686  1.00  0.00           O  
HETATM   36  O   UNL     1       5.306  -2.928  -1.027  1.00  0.00           O  
HETATM   37  O   UNL     1       7.036   1.525   2.710  1.00  0.00           O  
HETATM   38  H   UNL     1      -7.016  -0.226  -2.006  1.00  0.00           H  
HETATM   39  H   UNL     1     -10.763   0.178   1.457  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.993   0.766   3.364  1.00  0.00           H  
HETATM   41 HG21 UNL     1      -1.165   3.580  -1.413  1.00  0.00           H  
HETATM   42 HG22 UNL     1      -2.264   2.669  -0.350  1.00  0.00           H  
HETATM   43 HG23 UNL     1      -0.518   2.321  -0.334  1.00  0.00           H  
HETATM   44 HG11 UNL     1      -0.398   0.668  -3.637  1.00  0.00           H  
HETATM   45 HG12 UNL     1      -0.154   2.421  -3.449  1.00  0.00           H  
HETATM   46 HG13 UNL     1       0.565   1.291  -2.276  1.00  0.00           H  
HETATM   47  HG  UNL     1       3.375  -2.851   0.703  1.00  0.00           H  
HETATM   48 HD21 UNL     1       1.278  -4.855   1.652  1.00  0.00           H  
HETATM   49 HD22 UNL     1       2.404  -5.095   0.295  1.00  0.00           H  
HETATM   50 HD23 UNL     1       3.028  -4.962   1.957  1.00  0.00           H  
HETATM   51  HA  UNL     1       5.129   0.080  -1.546  1.00  0.00           H  
HETATM   52  HA  UNL     1       1.494  -0.562   0.786  1.00  0.00           H  
HETATM   53  HA  UNL     1      -1.940  -0.551  -2.207  1.00  0.00           H  
HETATM   54  H   UNL     1      -9.663  -0.153  -0.697  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.440   0.635   3.478  1.00  0.00           H  
HETATM   56  HB  UNL     1      -2.406   1.852  -2.687  1.00  0.00           H  
HETATM   57  HB1 UNL     1       1.395  -3.157  -0.817  1.00  0.00           H  
HETATM   58  HB2 UNL     1       0.330  -2.758   0.552  1.00  0.00           H  
HETATM   59 HD11 UNL     1       1.233  -2.714   2.872  1.00  0.00           H  
HETATM   60 HD12 UNL     1       2.995  -2.713   3.125  1.00  0.00           H  
HETATM   61 HD13 UNL     1       2.211  -1.332   2.320  1.00  0.00           H  
HETATM   62  H   UNL     1       6.849  -1.871  -1.686  1.00  0.00           H  
HETATM   63  H   UNL     1       6.301  -0.583   1.192  1.00  0.00           H  
HETATM   64  H   UNL     1       7.194   0.204  -0.131  1.00  0.00           H  
HETATM   65  H   UNL     1       4.633   1.295   1.141  1.00  0.00           H  
HETATM   66  H   UNL     1       6.387   2.122  -1.193  1.00  0.00           H  
HETATM   67  H   UNL     1       4.639   2.429  -0.924  1.00  0.00           H  
HETATM   68  H   UNL     1       6.585   4.346  -0.435  1.00  0.00           H  
HETATM   69  H   UNL     1       5.053   4.267   0.486  1.00  0.00           H  
HETATM   70  H   UNL     1       0.591  -0.628  -2.000  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.045   0.445   0.305  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.842   0.550   1.472  1.00  0.00           H  
HETATM   73  H   UNL     1       3.938  -1.045   0.883  1.00  0.00           H  
HETATM   74  H   UNL     1       7.261   3.996   1.942  1.00  0.00           H  
CONECT    1   15   14   14   38                                       
CONECT    2   16   17   17   39                                       
CONECT    3   18   18   17   40                                       
CONECT    4   19   41   42   43                                       
CONECT    5   19   44   45   46                                       
CONECT    6   20   21    7   47                                       
CONECT    7    6   48   49   50                                       
CONECT    8   23   22   31   51                                       
CONECT    9   33   33   31   10                                       
CONECT   10    9   28   20   52                                       
CONECT   11   12   35   35   28                                       
CONECT   12   19   11   29   53                                       
CONECT   13   29   14   34   34                                       
CONECT   14    1    1   13   30                                       
CONECT   15    1   16   16   18                                       
CONECT   16   15   15    2   54                                       
CONECT   17    2    2    3   55                                       
CONECT   18   15   30    3    3                                       
CONECT   19    5    4   12   56                                       
CONECT   20   10    6   57   58                                       
CONECT   21    6   59   60   61                                       
CONECT   22   36   36    8   62                                       
CONECT   23   24    8   63   64                                       
CONECT   24   25   27   23   65                                       
CONECT   25   26   24   66   67                                       
CONECT   26   25   32   68   69                                       
CONECT   27   32   24   37   37                                       
CONECT   28   11   10   70                                            
CONECT   29   12   13   71                                            
CONECT   30   14   18   72                                            
CONECT   31    8    9   73                                            
CONECT   32   26   27   74                                            
CONECT   33    9    9                                                 
CONECT   34   13   13                                                 
CONECT   35   11   11                                                 
CONECT   36   22   22                                                 
CONECT   37   27   27                                                 
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    4                                                      
CONECT   44    5                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50    7                                                      
CONECT   51    8                                                      
CONECT   52   10                                                      
CONECT   53   12                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   21                                                      
CONECT   61   21                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   25                                                      
CONECT   67   25                                                      
CONECT   68   26                                                      
CONECT   69   26                                                      
CONECT   70   28                                                      
CONECT   71   29                                                      
CONECT   72   30                                                      
CONECT   73   31                                                      
CONECT   74   32                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
