COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.446  -1.875   1.101  1.00  0.00           O  
HETATM    2  C   UNL     1       1.631  -1.199   0.111  1.00  0.00           C  
HETATM    3  N   UNL     1       2.878  -1.047  -0.377  1.00  0.00           N  
HETATM    4  CA  UNL     1       4.010  -1.698   0.288  1.00  0.00           C  
HETATM    5  C   UNL     1       4.144  -3.134  -0.222  1.00  0.00           C  
HETATM    6  O   UNL     1       4.480  -3.118  -1.610  1.00  0.00           O  
HETATM    7  C   UNL     1       5.295  -0.926  -0.020  1.00  0.00           C  
HETATM    8  C   UNL     1       5.211   0.471   0.599  1.00  0.00           C  
HETATM    9  C   UNL     1       6.420   1.273   0.193  1.00  0.00           C  
HETATM   10  C   UNL     1       6.328   2.190  -0.837  1.00  0.00           C  
HETATM   11  C   UNL     1       7.438   2.926  -1.208  1.00  0.00           C  
HETATM   12  C   UNL     1       8.640   2.745  -0.550  1.00  0.00           C  
HETATM   13  C   UNL     1       8.732   1.828   0.481  1.00  0.00           C  
HETATM   14  C   UNL     1       7.621   1.096   0.856  1.00  0.00           C  
HETATM   15  O   UNL     1       5.168   0.360   2.023  1.00  0.00           O  
HETATM   16  C   UNL     1       0.467  -0.535  -0.577  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.826  -0.871   0.169  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.008  -0.196  -0.529  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.301  -0.532   0.218  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.483   0.142  -0.481  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.776  -0.194   0.266  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.958   0.481  -0.432  1.00  0.00           C  
HETATM   23  C   UNL     1      -8.251   0.145   0.315  1.00  0.00           C  
HETATM   24  C   UNL     1      -9.433   0.819  -0.384  1.00  0.00           C  
HETATM   25  C   UNL     1     -10.726   0.483   0.363  1.00  0.00           C  
HETATM   26  C   UNL     1     -11.908   1.158  -0.335  1.00  0.00           C  
HETATM   27  C   UNL     1     -13.201   0.822   0.411  1.00  0.00           C  
HETATM   28  H   UNL     1       3.027  -0.507  -1.169  1.00  0.00           H  
HETATM   29  HA  UNL     1       3.841  -1.709   1.365  1.00  0.00           H  
HETATM   30  H1  UNL     1       4.928  -3.646   0.336  1.00  0.00           H  
HETATM   31  H2  UNL     1       3.198  -3.658  -0.083  1.00  0.00           H  
HETATM   32  H   UNL     1       4.581  -3.997  -2.001  1.00  0.00           H  
HETATM   33  H   UNL     1       6.148  -1.459   0.401  1.00  0.00           H  
HETATM   34  H   UNL     1       5.417  -0.839  -1.099  1.00  0.00           H  
HETATM   35  H   UNL     1       4.309   0.971   0.246  1.00  0.00           H  
HETATM   36  H   UNL     1       5.390   2.332  -1.351  1.00  0.00           H  
HETATM   37  H   UNL     1       7.366   3.642  -2.014  1.00  0.00           H  
HETATM   38  H   UNL     1       9.507   3.319  -0.840  1.00  0.00           H  
HETATM   39  H   UNL     1       9.671   1.687   0.996  1.00  0.00           H  
HETATM   40  H   UNL     1       7.692   0.382   1.663  1.00  0.00           H  
HETATM   41  H   UNL     1       5.941  -0.076   2.407  1.00  0.00           H  
HETATM   42  H   UNL     1       0.614   0.545  -0.580  1.00  0.00           H  
HETATM   43  H   UNL     1       0.397  -0.895  -1.604  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.973  -1.951   0.173  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.756  -0.511   1.196  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.861   0.884  -0.532  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.078  -0.557  -1.555  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.448  -1.612   0.221  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.231  -0.172   1.244  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.335   1.222  -0.484  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.552  -0.218  -1.507  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.923  -1.274   0.269  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.706   0.166   1.293  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.811   1.561  -0.435  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.028   0.121  -1.459  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.398  -0.935   0.318  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.181   0.505   1.341  1.00  0.00           H  
HETATM   58  H   UNL     1      -9.285   1.899  -0.387  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.502   0.459  -1.410  1.00  0.00           H  
HETATM   60  H   UNL     1     -10.873  -0.596   0.366  1.00  0.00           H  
HETATM   61  H   UNL     1     -10.656   0.844   1.389  1.00  0.00           H  
HETATM   62  H   UNL     1     -11.760   2.238  -0.338  1.00  0.00           H  
HETATM   63  H   UNL     1     -11.977   0.798  -1.362  1.00  0.00           H  
HETATM   64  H   UNL     1     -13.348  -0.258   0.414  1.00  0.00           H  
HETATM   65  H   UNL     1     -13.131   1.182   1.438  1.00  0.00           H  
HETATM   66  H   UNL     1     -14.043   1.303  -0.086  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   16                                       
CONECT    3    2    4   28                                            
CONECT    4    3    5    7   29                                       
CONECT    5    4    6   30   31                                       
CONECT    6    5   32                                                 
CONECT    7    4    8   33   34                                       
CONECT    8    7    9   15   35                                       
CONECT    9    8   10   10   14                                       
CONECT   10    9    9   11   36                                       
CONECT   11   10   12   12   37                                       
CONECT   12   11   11   13   38                                       
CONECT   13   12   14   14   39                                       
CONECT   14    9   13   13   40                                       
CONECT   15    8   41                                                 
CONECT   16    2   17   42   43                                       
CONECT   17   16   18   44   45                                       
CONECT   18   17   19   46   47                                       
CONECT   19   18   20   48   49                                       
CONECT   20   19   21   50   51                                       
CONECT   21   20   22   52   53                                       
CONECT   22   21   23   54   55                                       
CONECT   23   22   24   56   57                                       
CONECT   24   23   25   58   59                                       
CONECT   25   24   26   60   61                                       
CONECT   26   25   27   62   63                                       
CONECT   27   26   64   65   66                                       
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   27                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
