COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.997   3.729   0.552  1.00  0.00           C  
HETATM    2  C   UNL     1       3.358   3.957   0.622  1.00  0.00           C  
HETATM    3  C   UNL     1       6.894  -0.412   0.235  1.00  0.00           C  
HETATM    4  C   UNL     1       8.737  -2.475   0.469  1.00  0.00           C  
HETATM    5  C   UNL     1       9.117  -1.268  -0.114  1.00  0.00           C  
HETATM    6  C   UNL     1       1.512   2.429   0.485  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.686   1.891   0.136  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.372  -0.473  -1.584  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.199  -1.310  -2.113  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.666  -0.243  -1.363  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.282  -0.078  -1.217  1.00  0.00           C  
HETATM   12  O   UNL     1       0.431   0.386  -0.833  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.341   1.167  -0.311  1.00  0.00           C  
HETATM   14  N   UNL     1       0.134   2.199   0.414  1.00  0.00           N  
HETATM   15  C   UNL     1       2.395   1.359   0.488  1.00  0.00           C  
HETATM   16  C   UNL     1       3.761   1.591   0.558  1.00  0.00           C  
HETATM   17  N   UNL     1       4.655   0.516   0.562  1.00  0.00           N  
HETATM   18  C   UNL     1       5.914   0.684   0.112  1.00  0.00           C  
HETATM   19  C   UNL     1       8.201  -0.240  -0.231  1.00  0.00           C  
HETATM   20  O   UNL     1      10.382  -1.090  -0.585  1.00  0.00           O  
HETATM   21  C   UNL     1      11.375  -2.014  -0.126  1.00  0.00           C  
HETATM   22  C   UNL     1      10.797  -3.432  -0.231  1.00  0.00           C  
HETATM   23  O   UNL     1       9.623  -3.499   0.586  1.00  0.00           O  
HETATM   24  C   UNL     1       7.440  -2.643   0.940  1.00  0.00           C  
HETATM   25  C   UNL     1       6.521  -1.623   0.821  1.00  0.00           C  
HETATM   26  O   UNL     1       6.243   1.740  -0.394  1.00  0.00           O  
HETATM   27  C   UNL     1       4.240   2.894   0.625  1.00  0.00           C  
HETATM   28  C   UNL     1       1.038   4.891   0.556  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.798   0.985  -0.470  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.553   0.673  -0.743  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.029   1.742   0.008  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.557  -1.408  -2.218  1.00  0.00           C  
HETATM   33  N   UNL     1      -5.873   0.516  -0.882  1.00  0.00           N  
HETATM   34  H   UNL     1       3.733   4.968   0.674  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.294   2.714   0.714  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.552  -2.026  -2.598  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.598  -0.771  -1.685  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.480   2.783   0.887  1.00  0.00           H  
HETATM   39  H   UNL     1       2.020   0.347   0.437  1.00  0.00           H  
HETATM   40  H   UNL     1       4.369  -0.352   0.888  1.00  0.00           H  
HETATM   41  H   UNL     1       8.494   0.697  -0.682  1.00  0.00           H  
HETATM   42  H   UNL     1      12.267  -1.933  -0.747  1.00  0.00           H  
HETATM   43  H   UNL     1      11.628  -1.795   0.911  1.00  0.00           H  
HETATM   44  H   UNL     1      10.536  -3.646  -1.268  1.00  0.00           H  
HETATM   45  H   UNL     1      11.533  -4.155   0.120  1.00  0.00           H  
HETATM   46  H   UNL     1       7.148  -3.580   1.390  1.00  0.00           H  
HETATM   47  H   UNL     1       5.512  -1.761   1.182  1.00  0.00           H  
HETATM   48  H   UNL     1       5.304   3.075   0.679  1.00  0.00           H  
HETATM   49  H   UNL     1       0.765   5.134   1.582  1.00  0.00           H  
HETATM   50  H   UNL     1       1.513   5.756   0.092  1.00  0.00           H  
HETATM   51  H   UNL     1       0.142   4.625  -0.005  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.697   2.444   0.484  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.999  -2.211  -2.789  1.00  0.00           H  
HETATM   54  C   UNL     1      -7.869  -0.602  -1.707  1.00  0.00           C  
HETATM   55  C   UNL     1      -8.494  -0.646  -0.312  1.00  0.00           C  
HETATM   56  C   UNL     1     -10.013  -0.777  -0.437  1.00  0.00           C  
HETATM   57  N   UNL     1     -10.613  -0.820   0.903  1.00  0.00           N  
HETATM   58  C   UNL     1     -12.081  -0.706   0.828  1.00  0.00           C  
HETATM   59  C   UNL     1     -12.673  -1.946   1.531  1.00  0.00           C  
HETATM   60  C   UNL     1     -11.518  -2.406   2.459  1.00  0.00           C  
HETATM   61  C   UNL     1     -10.274  -2.081   1.595  1.00  0.00           C  
HETATM   62  H   UNL     1      -8.263   0.255  -2.255  1.00  0.00           H  
HETATM   63  H   UNL     1      -8.112  -1.519  -2.244  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.100  -1.503   0.236  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.251   0.271   0.225  1.00  0.00           H  
HETATM   66  H   UNL     1     -10.407   0.079  -0.984  1.00  0.00           H  
HETATM   67  H   UNL     1     -10.256  -1.694  -0.974  1.00  0.00           H  
HETATM   68  H   UNL     1     -12.409   0.200   1.338  1.00  0.00           H  
HETATM   69  H   UNL     1     -12.399  -0.683  -0.214  1.00  0.00           H  
HETATM   70  H   UNL     1     -13.552  -1.676   2.115  1.00  0.00           H  
HETATM   71  H   UNL     1     -12.915  -2.722   0.804  1.00  0.00           H  
HETATM   72  H   UNL     1     -11.510  -1.832   3.386  1.00  0.00           H  
HETATM   73  H   UNL     1     -11.583  -3.474   2.664  1.00  0.00           H  
HETATM   74  H   UNL     1     -10.097  -2.876   0.871  1.00  0.00           H  
HETATM   75  H   UNL     1      -9.398  -1.942   2.229  1.00  0.00           H  
CONECT    1   28    6    6    2                                       
CONECT    2    1   27   27   34                                       
CONECT    3   18   25   25   19                                       
CONECT    4   24   24    5   23                                       
CONECT    5   19   19    4   20                                       
CONECT    6   14    1    1   15                                       
CONECT    7   31   29   29   35                                       
CONECT    8   32   33   33   54                                       
CONECT    9   32   32   10   36                                       
CONECT   10    9   30   11   11                                       
CONECT   11   10   10   29   37                                       
CONECT   12   13   13                                                 
CONECT   13   29   14   12   12                                       
CONECT   14   13    6   38                                            
CONECT   15    6   16   16   39                                       
CONECT   16   15   15   27   17                                       
CONECT   17   16   18   40                                            
CONECT   18   17   26   26    3                                       
CONECT   19    3    5    5   41                                       
CONECT   20    5   21                                                 
CONECT   21   20   22   42   43                                       
CONECT   22   23   21   44   45                                       
CONECT   23    4   22                                                 
CONECT   24   25    4    4   46                                       
CONECT   25    3    3   24   47                                       
CONECT   26   18   18                                                 
CONECT   27    2    2   16   48                                       
CONECT   28    1   49   50   51                                       
CONECT   29   11    7    7   13                                       
CONECT   30   33   10   31   31                                       
CONECT   31   30   30    7   52                                       
CONECT   32    8    9    9   53                                       
CONECT   33    8    8   30                                            
CONECT   34    2                                                      
CONECT   35    7                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   17                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   31                                                      
CONECT   53   32                                                      
CONECT   54    8   55   62   63                                       
CONECT   55   54   56   64   65                                       
CONECT   56   55   57   66   67                                       
CONECT   57   56   58   61                                            
CONECT   58   57   59   68   69                                       
CONECT   59   58   60   70   71                                       
CONECT   60   59   61   72   73                                       
CONECT   61   60   57   74   75                                       
CONECT   62   54                                                      
CONECT   63   54                                                      
CONECT   64   55                                                      
CONECT   65   55                                                      
CONECT   66   56                                                      
CONECT   67   56                                                      
CONECT   68   58                                                      
CONECT   69   58                                                      
CONECT   70   59                                                      
CONECT   71   59                                                      
CONECT   72   60                                                      
CONECT   73   60                                                      
CONECT   74   61                                                      
CONECT   75   61                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
