COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.127   2.903   0.439  1.00  0.00           C  
HETATM    2  C   UNL     1       4.315   4.197   1.250  1.00  0.00           C  
HETATM    3  C   UNL     1       5.698   4.299   0.581  1.00  0.00           C  
HETATM    4  C   UNL     1       1.451  -2.049   0.391  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.809  -3.029   0.827  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.932   0.638  -0.157  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.686  -0.400  -0.690  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.067  -0.294  -0.748  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.026  -1.933   0.453  1.00  0.00           C  
HETATM   10  N   UNL     1       4.919   0.309  -0.651  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.946  -0.678   0.208  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.183  -2.873   0.870  1.00  0.00           C  
HETATM   13  C   UNL     1       6.561   0.512  -2.453  1.00  0.00           C  
HETATM   14  C   UNL     1       6.196   0.923  -1.025  1.00  0.00           C  
HETATM   15  C   UNL     1       6.071   2.446  -0.949  1.00  0.00           C  
HETATM   16  N   UNL     1       5.604   2.832   0.389  1.00  0.00           N  
HETATM   17  C   UNL     1       4.893  -0.946  -0.159  1.00  0.00           C  
HETATM   18  O   UNL     1       5.935  -1.537   0.054  1.00  0.00           O  
HETATM   19  C   UNL     1       3.605  -1.600   0.121  1.00  0.00           C  
HETATM   20  C   UNL     1       2.351  -1.028   0.033  1.00  0.00           C  
HETATM   21  N   UNL     1       3.414  -2.894   0.518  1.00  0.00           N  
HETATM   22  C   UNL     1       4.481  -3.873   0.739  1.00  0.00           C  
HETATM   23  N   UNL     1       2.159  -3.124   0.668  1.00  0.00           N  
HETATM   24  N   UNL     1      -0.627  -0.784   0.154  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.712  -1.699   0.564  1.00  0.00           N  
HETATM   26  N   UNL     1      -2.539   0.535  -0.104  1.00  0.00           N  
HETATM   27  C   UNL     1      -4.562   1.780   0.317  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.944   1.882   0.264  1.00  0.00           C  
HETATM   29  O   UNL     1      -6.561   3.000   0.727  1.00  0.00           O  
HETATM   30  C   UNL     1      -7.987   3.037   0.641  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.696   0.848  -0.274  1.00  0.00           C  
HETATM   32  O   UNL     1      -6.804  -1.309  -1.269  1.00  0.00           O  
HETATM   33  C   UNL     1      -8.222  -1.133  -1.298  1.00  0.00           C  
HETATM   34  H   UNL     1       3.667   2.093   1.005  1.00  0.00           H  
HETATM   35  H   UNL     1       3.662   3.059  -0.534  1.00  0.00           H  
HETATM   36  H   UNL     1       3.631   4.997   0.967  1.00  0.00           H  
HETATM   37  H   UNL     1       4.358   4.037   2.328  1.00  0.00           H  
HETATM   38  H   UNL     1       5.694   4.863  -0.351  1.00  0.00           H  
HETATM   39  H   UNL     1       6.493   4.604   1.261  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.352  -3.976   1.071  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.196  -1.288  -1.059  1.00  0.00           H  
HETATM   42  H   UNL     1       4.093   0.805  -0.759  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.817  -3.701   1.151  1.00  0.00           H  
HETATM   44  H   UNL     1       7.511   0.969  -2.730  1.00  0.00           H  
HETATM   45  H   UNL     1       6.650  -0.573  -2.507  1.00  0.00           H  
HETATM   46  H   UNL     1       5.783   0.847  -3.138  1.00  0.00           H  
HETATM   47  H   UNL     1       6.975   0.587  -0.340  1.00  0.00           H  
HETATM   48  H   UNL     1       7.043   2.900  -1.140  1.00  0.00           H  
HETATM   49  H   UNL     1       5.356   2.789  -1.696  1.00  0.00           H  
HETATM   50  H   UNL     1       2.112  -0.014  -0.251  1.00  0.00           H  
HETATM   51  H   UNL     1       4.798  -3.835   1.782  1.00  0.00           H  
HETATM   52  H   UNL     1       4.112  -4.872   0.509  1.00  0.00           H  
HETATM   53  H   UNL     1       5.327  -3.640   0.093  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.988   1.312  -0.286  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.977   2.590   0.727  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.351   3.982   1.045  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.291   2.946  -0.401  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.407   2.211   1.216  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.772   0.929  -0.319  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.467  -0.255  -1.896  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.689  -2.014  -1.737  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.592  -0.994  -0.282  1.00  0.00           H  
CONECT    1    2   16   34   35                                       
CONECT    2    3    1   36   37                                       
CONECT    3    2   16   38   39                                       
CONECT    4   20   23   23    9                                       
CONECT    5    9   12   12   40                                       
CONECT    6    7    7   27   26                                       
CONECT    7    8    6    6   41                                       
CONECT    8   32   31   31    7                                       
CONECT    9    4   24   24    5                                       
CONECT   10   14   17   42                                            
CONECT   11   24   26   25   25                                       
CONECT   12    5    5   25   43                                       
CONECT   13   14   44   45   46                                       
CONECT   14   13   15   10   47                                       
CONECT   15   14   16   48   49                                       
CONECT   16    3   15    1                                            
CONECT   17   18   18   10   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   21   20   20                                       
CONECT   20   19   19    4   50                                       
CONECT   21   19   22   23                                            
CONECT   22   21   51   52   53                                       
CONECT   23   21    4    4                                            
CONECT   24    9    9   11                                            
CONECT   25   11   11   12                                            
CONECT   26    6   11   54                                            
CONECT   27   28   28    6   55                                       
CONECT   28   31   29   27   27                                       
CONECT   29   28   30                                                 
CONECT   30   29   56   57   58                                       
CONECT   31    8    8   28   59                                       
CONECT   32   33    8                                                 
CONECT   33   32   60   61   62                                       
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    5                                                      
CONECT   41    7                                                      
CONECT   42   10                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   20                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
