COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.174  -3.933  -0.613  1.00  0.00           C  
HETATM    2  C   UNL     1       5.103  -2.880  -0.103  1.00  0.00           C  
HETATM    3  C   UNL     1       5.705  -1.673  -0.430  1.00  0.00           C  
HETATM    4  C   UNL     1       4.989  -0.498  -0.348  1.00  0.00           C  
HETATM    5  C   UNL     1       3.654  -0.521   0.064  1.00  0.00           C  
HETATM    6  N   UNL     1      -7.025  -0.314  -0.256  1.00  0.00           N  
HETATM    7  C   UNL     1      -0.951   1.251  -0.874  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.500   0.883  -0.084  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.239  -1.399  -0.314  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.763  -2.686  -0.497  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.543  -3.590  -0.426  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.000  -2.351  -0.247  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.838  -1.233  -0.188  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.661   0.882   1.435  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.141   0.979   1.599  1.00  0.00           C  
HETATM   16  C   UNL     1       1.520   3.086   0.780  1.00  0.00           C  
HETATM   17  C   UNL     1       3.025   3.093   0.805  1.00  0.00           C  
HETATM   18  O   UNL     1       5.814  -4.036  -0.185  1.00  0.00           O  
HETATM   19  C   UNL     1       2.885   0.734   0.146  1.00  0.00           C  
HETATM   20  N   UNL     1       1.644   0.720   0.523  1.00  0.00           N  
HETATM   21  N   UNL     1       0.892   1.901   0.598  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.567   1.852   0.480  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.476   1.145  -0.967  1.00  0.00           C  
HETATM   24  N   UNL     1      -2.976   0.299   0.124  1.00  0.00           N  
HETATM   25  C   UNL     1      -4.330   0.078  -0.005  1.00  0.00           C  
HETATM   26  N   UNL     1      -5.191   1.084   0.039  1.00  0.00           N  
HETATM   27  N   UNL     1      -7.346   1.976  -0.029  1.00  0.00           N  
HETATM   28  C   UNL     1      -5.919  -3.755  -0.550  1.00  0.00           C  
HETATM   29  O   UNL     1       0.889   4.112   0.923  1.00  0.00           O  
HETATM   30  C   UNL     1       3.593   4.468   0.502  1.00  0.00           C  
HETATM   31  C   UNL     1       3.496   4.789  -0.959  1.00  0.00           C  
HETATM   32  C   UNL     1       3.262   3.905  -1.873  1.00  0.00           C  
HETATM   33  C   UNL     1       3.035   2.450  -1.604  1.00  0.00           C  
HETATM   34  C   UNL     1       3.536   2.059  -0.208  1.00  0.00           C  
HETATM   35  C   UNL     1       3.048  -1.736   0.392  1.00  0.00           C  
HETATM   36  C   UNL     1       3.774  -2.910   0.313  1.00  0.00           C  
HETATM   37  O   UNL     1       3.188  -4.095   0.632  1.00  0.00           O  
HETATM   38  C   UNL     1       1.819  -4.052   1.040  1.00  0.00           C  
HETATM   39  H   UNL     1       7.208  -3.497  -1.611  1.00  0.00           H  
HETATM   40  H   UNL     1       7.726  -3.298   0.080  1.00  0.00           H  
HETATM   41  H   UNL     1       7.624  -4.925  -0.634  1.00  0.00           H  
HETATM   42  H   UNL     1       6.737  -1.655  -0.748  1.00  0.00           H  
HETATM   43  H   UNL     1       5.460   0.440  -0.602  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.582   1.891  -1.675  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.512   0.258  -0.970  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.829  -2.829  -0.595  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.896  -4.454  -0.471  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.930  -2.235  -0.151  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.072   0.249   2.221  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.098   1.878   1.504  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.908   1.425   2.565  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.705  -0.019   1.543  1.00  0.00           H  
HETATM   53  H   UNL     1       3.359   2.802   1.801  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.974   2.860   0.560  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.914   2.140  -0.886  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.751   0.704  -1.925  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.304   1.853  -0.116  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.981   2.866   0.097  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.325  -4.746  -0.691  1.00  0.00           H  
HETATM   60  H   UNL     1       3.039   5.215   1.070  1.00  0.00           H  
HETATM   61  H   UNL     1       4.640   4.495   0.804  1.00  0.00           H  
HETATM   62  H   UNL     1       3.628   5.816  -1.265  1.00  0.00           H  
HETATM   63  H   UNL     1       3.228   4.238  -2.900  1.00  0.00           H  
HETATM   64  H   UNL     1       1.969   2.236  -1.673  1.00  0.00           H  
HETATM   65  H   UNL     1       3.567   1.862  -2.351  1.00  0.00           H  
HETATM   66  H   UNL     1       4.622   1.983  -0.176  1.00  0.00           H  
HETATM   67  H   UNL     1       2.017  -1.758   0.711  1.00  0.00           H  
HETATM   68  H   UNL     1       1.475  -5.062   1.264  1.00  0.00           H  
HETATM   69  H   UNL     1       1.724  -3.430   1.930  1.00  0.00           H  
HETATM   70  H   UNL     1       1.214  -3.632   0.237  1.00  0.00           H  
CONECT    1   18   39   40   41                                       
CONECT    2   36   36    3   18                                       
CONECT    3    4    4    2   42                                       
CONECT    4    5    3    3   43                                       
CONECT    5   19   35   35    4                                       
CONECT    6    8    9    9                                            
CONECT    7   22   23   44   45                                       
CONECT    8   27   26   26    6                                       
CONECT    9    6    6   13   10                                       
CONECT   10    9   28   28   46                                       
CONECT   11   12   12   28   47                                       
CONECT   12   13   11   11   48                                       
CONECT   13   25   25    9   12                                       
CONECT   14   24   15   49   50                                       
CONECT   15   14   22   51   52                                       
CONECT   16   29   29   21   17                                       
CONECT   17   16   30   34   53                                       
CONECT   18    2    1                                                 
CONECT   19   20   20   34    5                                       
CONECT   20   21   19   19                                            
CONECT   21   22   16   20                                            
CONECT   22   15    7   21   54                                       
CONECT   23   24    7   55   56                                       
CONECT   24   14   25   23                                            
CONECT   25   26   24   13   13                                       
CONECT   26    8    8   25                                            
CONECT   27    8   57   58                                            
CONECT   28   10   10   11   59                                       
CONECT   29   16   16                                                 
CONECT   30   17   31   60   61                                       
CONECT   31   30   32   32   62                                       
CONECT   32   31   31   33   63                                       
CONECT   33   34   32   64   65                                       
CONECT   34   17   19   33   66                                       
CONECT   35    5    5   36   67                                       
CONECT   36   35   37    2    2                                       
CONECT   37   38   36                                                 
CONECT   38   37   68   69   70                                       
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   23                                                      
CONECT   57   27                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   32                                                      
CONECT   64   33                                                      
CONECT   65   33                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
CONECT   68   38                                                      
CONECT   69   38                                                      
CONECT   70   38                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
