COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1     -10.264   0.561   0.477  1.00  0.00           N  
HETATM    2  C   UNL     1      -9.246  -0.272   0.771  1.00  0.00           C  
HETATM    3  O   UNL     1      -9.417  -1.191   1.548  1.00  0.00           O  
HETATM    4  C   UNL     1      -7.921  -0.068   0.147  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.975   0.780   0.495  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.265   1.782   1.408  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.974   2.255   0.734  1.00  0.00           C  
HETATM    8  C   UNL     1       1.289   1.317   0.449  1.00  0.00           C  
HETATM    9  C   UNL     1       3.398   0.426   0.181  1.00  0.00           C  
HETATM   10  C   UNL     1       3.631  -1.873  -0.072  1.00  0.00           C  
HETATM   11  C   UNL     1       3.432  -2.618   1.083  1.00  0.00           C  
HETATM   12  C   UNL     1       3.862  -2.066   2.418  1.00  0.00           C  
HETATM   13  C   UNL     1       2.842  -3.861   1.011  1.00  0.00           C  
HETATM   14  C   UNL     1       2.444  -4.372  -0.227  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.720   0.989  -0.741  1.00  0.00           C  
HETATM   16  C   UNL     1       1.830  -5.663  -0.307  1.00  0.00           C  
HETATM   17  C   UNL     1       2.646  -3.619  -1.387  1.00  0.00           C  
HETATM   18  C   UNL     1       3.236  -2.377  -1.306  1.00  0.00           C  
HETATM   19  C   UNL     1       3.454  -1.564  -2.556  1.00  0.00           C  
HETATM   20  C   UNL     1       3.938   1.721   0.268  1.00  0.00           C  
HETATM   21  C   UNL     1       3.060   2.792   0.440  1.00  0.00           C  
HETATM   22  C   UNL     1       5.399   1.944   0.168  1.00  0.00           C  
HETATM   23  C   UNL     1       5.922   2.904  -0.706  1.00  0.00           C  
HETATM   24  C   UNL     1       7.288   3.079  -0.767  1.00  0.00           C  
HETATM   25  C   UNL     1       7.646   1.445   0.824  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.479   1.178  -1.315  1.00  0.00           C  
HETATM   27  C   UNL     1       6.294   1.205   0.948  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.864  -0.928   0.449  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.630  -0.732  -0.136  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.436   0.321  -1.012  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.084   0.533  -1.643  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.053   1.840  -1.480  1.00  0.00           C  
HETATM   33  C   UNL     1      -1.315   2.873  -0.625  1.00  0.00           C  
HETATM   34  N   UNL     1      -3.280   1.420  -0.791  1.00  0.00           N  
HETATM   35  N   UNL     1      -0.075   1.114   0.542  1.00  0.00           N  
HETATM   36  N   UNL     1       2.084   0.271   0.276  1.00  0.00           N  
HETATM   37  N   UNL     1       1.343  -6.688  -0.370  1.00  0.00           N  
HETATM   38  N   UNL     1       1.763   2.552   0.530  1.00  0.00           N  
HETATM   39  N   UNL     1       8.098   2.356  -0.017  1.00  0.00           N  
HETATM   40  O   UNL     1       4.207  -0.646   0.004  1.00  0.00           O  
HETATM   41  H   UNL     1     -11.133   0.426   0.886  1.00  0.00           H  
HETATM   42  H   UNL     1     -10.127   1.296  -0.140  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.328  -0.081   0.328  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.902   0.453   0.966  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.917   2.637   1.587  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.025   1.303   2.358  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.487   3.001   1.361  1.00  0.00           H  
HETATM   48  H   UNL     1       3.041  -1.501   2.859  1.00  0.00           H  
HETATM   49  H   UNL     1       4.135  -2.887   3.080  1.00  0.00           H  
HETATM   50  H   UNL     1       4.721  -1.410   2.280  1.00  0.00           H  
HETATM   51  H   UNL     1       2.689  -4.439   1.910  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.533   1.659  -0.979  1.00  0.00           H  
HETATM   53  H   UNL     1       2.340  -4.011  -2.346  1.00  0.00           H  
HETATM   54  H   UNL     1       4.431  -1.800  -2.977  1.00  0.00           H  
HETATM   55  H   UNL     1       2.678  -1.802  -3.284  1.00  0.00           H  
HETATM   56  H   UNL     1       3.410  -0.503  -2.312  1.00  0.00           H  
HETATM   57  H   UNL     1       3.436   3.803   0.503  1.00  0.00           H  
HETATM   58  H   UNL     1       5.264   3.498  -1.323  1.00  0.00           H  
HETATM   59  H   UNL     1       7.701   3.817  -1.439  1.00  0.00           H  
HETATM   60  H   UNL     1       8.345   0.876   1.419  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.323   1.995  -2.003  1.00  0.00           H  
HETATM   62  H   UNL     1       5.931   0.458   1.639  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.012  -1.746   1.139  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.812  -1.397   0.097  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.578  -0.427  -1.748  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.209   0.988  -2.625  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.309   2.282  -2.443  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.410   0.974  -1.637  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.952   3.746  -0.479  1.00  0.00           H  
HETATM   70  H   UNL     1      -0.396   3.173  -1.129  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.438   0.216   0.481  1.00  0.00           H  
CONECT    1    2   41   42                                            
CONECT    2    4    1    3    3                                       
CONECT    3    2    2                                                 
CONECT    4   15   15   28    2                                       
CONECT    5   34    6   43   44                                       
CONECT    6    7    5   45   46                                       
CONECT    7   33   35    6   47                                       
CONECT    8   38   35   36   36                                       
CONECT    9   20   20   36   40                                       
CONECT   10   40   18   18   11                                       
CONECT   11   10   12   13   13                                       
CONECT   12   11   48   49   50                                       
CONECT   13   11   11   14   51                                       
CONECT   14   17   17   13   16                                       
CONECT   15   26    4    4   52                                       
CONECT   16   14   37   37   37                                       
CONECT   17   18   14   14   53                                       
CONECT   18   19   10   10   17                                       
CONECT   19   18   54   55   56                                       
CONECT   20   21   22    9    9                                       
CONECT   21   38   38   20   57                                       
CONECT   22   27   20   23   23                                       
CONECT   23   22   22   24   58                                       
CONECT   24   39   39   23   59                                       
CONECT   25   27   27   39   60                                       
CONECT   26   30   30   15   61                                       
CONECT   27   25   25   22   62                                       
CONECT   28   29   29    4   63                                       
CONECT   29   30   28   28   64                                       
CONECT   30   31   26   26   29                                       
CONECT   31   34   30   65   66                                       
CONECT   32   33   34   67   68                                       
CONECT   33   32    7   69   70                                       
CONECT   34   32   31    5                                            
CONECT   35    8    7   71                                            
CONECT   36    8    8    9                                            
CONECT   37   16   16   16                                            
CONECT   38   21   21    8                                            
CONECT   39   25   24   24                                            
CONECT   40    9   10                                                 
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   19                                                      
CONECT   57   21                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   31                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   32                                                      
CONECT   69   33                                                      
CONECT   70   33                                                      
CONECT   71   35                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
