COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.005  -2.853  -2.595  1.00  0.00           O  
HETATM    2  C   UNL     1      -6.152   0.446   2.022  1.00  0.00           C  
HETATM    3  O   UNL     1       5.551  -0.889  -1.717  1.00  0.00           O  
HETATM    4  C   UNL     1      -4.948   0.984   1.681  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.358   1.261  -0.616  1.00  0.00           C  
HETATM    6  N   UNL     1      -4.988  -0.094  -0.434  1.00  0.00           N  
HETATM    7  C   UNL     1      -4.382   0.694   0.431  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.137   0.918   1.101  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.734   0.827  -1.247  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.455   1.571  -1.638  1.00  0.00           C  
HETATM   11  O   UNL     1       0.897   2.765  -1.933  1.00  0.00           O  
HETATM   12  C   UNL     1       0.887   2.037  -0.963  1.00  0.00           C  
HETATM   13  N   UNL     1       1.988   1.922  -0.195  1.00  0.00           N  
HETATM   14  C   UNL     1       3.198   2.677  -0.532  1.00  0.00           C  
HETATM   15  C   UNL     1       3.151   4.068   0.123  1.00  0.00           C  
HETATM   16  C   UNL     1       4.367   4.152   1.068  1.00  0.00           C  
HETATM   17  C   UNL     1       4.701   2.674   1.389  1.00  0.00           C  
HETATM   18  C   UNL     1       4.442   1.963   0.038  1.00  0.00           C  
HETATM   19  C   UNL     1       4.152   0.478   0.261  1.00  0.00           C  
HETATM   20  C   UNL     1       5.432  -0.231   0.706  1.00  0.00           C  
HETATM   21  C   UNL     1       5.147  -1.694   0.926  1.00  0.00           C  
HETATM   22  C   UNL     1       4.979  -2.181   2.205  1.00  0.00           C  
HETATM   23  C   UNL     1       4.711  -3.523   2.408  1.00  0.00           C  
HETATM   24  C   UNL     1       4.609  -4.386   1.331  1.00  0.00           C  
HETATM   25  C   UNL     1       4.775  -3.912   0.046  1.00  0.00           C  
HETATM   26  C   UNL     1       5.046  -2.559  -0.166  1.00  0.00           C  
HETATM   27  C   UNL     1       5.218  -2.043  -1.539  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.840   1.664   0.780  1.00  0.00           C  
HETATM   29  N   UNL     1      -3.156   1.249   0.097  1.00  0.00           N  
HETATM   30  C   UNL     1      -6.792  -0.401   1.095  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.166  -0.660  -0.149  1.00  0.00           C  
HETATM   32  C   UNL     1      -8.028  -0.999   1.387  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.612  -1.821   0.471  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.998  -2.078  -0.752  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.805  -1.505  -1.073  1.00  0.00           C  
HETATM   36  C   UNL     1      -6.159  -1.796  -2.403  1.00  0.00           C  
HETATM   37  H   UNL     1       5.131  -2.471  -3.474  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.602   0.659   2.980  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.431   1.634   2.371  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.137   0.193  -0.631  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.951  -0.156   1.089  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.491   1.214   2.089  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.522   1.057  -1.964  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.545  -0.246  -1.247  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.648   2.644  -1.651  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.134   1.246  -2.627  1.00  0.00           H  
HETATM   47  H   UNL     1       1.980   1.340   0.581  1.00  0.00           H  
HETATM   48  H   UNL     1       3.287   2.776  -1.614  1.00  0.00           H  
HETATM   49  H   UNL     1       3.217   4.843  -0.640  1.00  0.00           H  
HETATM   50  H   UNL     1       2.228   4.182   0.692  1.00  0.00           H  
HETATM   51  H   UNL     1       5.207   4.632   0.567  1.00  0.00           H  
HETATM   52  H   UNL     1       4.107   4.693   1.978  1.00  0.00           H  
HETATM   53  H   UNL     1       5.745   2.569   1.686  1.00  0.00           H  
HETATM   54  H   UNL     1       4.040   2.288   2.165  1.00  0.00           H  
HETATM   55  H   UNL     1       5.294   2.091  -0.630  1.00  0.00           H  
HETATM   56  H   UNL     1       3.389   0.368   1.032  1.00  0.00           H  
HETATM   57  H   UNL     1       3.795   0.034  -0.669  1.00  0.00           H  
HETATM   58  H   UNL     1       6.195  -0.121  -0.065  1.00  0.00           H  
HETATM   59  H   UNL     1       5.789   0.213   1.636  1.00  0.00           H  
HETATM   60  H   UNL     1       5.057  -1.513   3.051  1.00  0.00           H  
HETATM   61  H   UNL     1       4.581  -3.900   3.412  1.00  0.00           H  
HETATM   62  H   UNL     1       4.400  -5.432   1.497  1.00  0.00           H  
HETATM   63  H   UNL     1       4.697  -4.586  -0.794  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.080   1.406   1.516  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.022   2.738   0.805  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.513  -0.808   2.332  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.558  -2.288   0.701  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.480  -2.733  -1.462  1.00  0.00           H  
HETATM   69  H   UNL     1      -6.498  -1.067  -3.139  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.075  -1.733  -2.303  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.436  -2.798  -2.730  1.00  0.00           H  
CONECT    1   27   37                                                 
CONECT    2   30    4    4   38                                       
CONECT    3   27   27                                                 
CONECT    4    2    2    7   39                                       
CONECT    5   10   28   12   40                                       
CONECT    6   31    7    7                                            
CONECT    7    6    6    4   29                                       
CONECT    8   29   28   41   42                                       
CONECT    9   29   10   43   44                                       
CONECT   10    9    5   45   46                                       
CONECT   11   12   12                                                 
CONECT   12    5   11   11   13                                       
CONECT   13   12   14   47                                            
CONECT   14   13   18   15   48                                       
CONECT   15   14   16   49   50                                       
CONECT   16   15   17   51   52                                       
CONECT   17   18   16   53   54                                       
CONECT   18   19   14   17   55                                       
CONECT   19   20   18   56   57                                       
CONECT   20   21   19   58   59                                       
CONECT   21   22   22   26   20                                       
CONECT   22   23   21   21   60                                       
CONECT   23   24   24   22   61                                       
CONECT   24   23   23   25   62                                       
CONECT   25   24   26   26   63                                       
CONECT   26   25   25   21   27                                       
CONECT   27   26    3    3    1                                       
CONECT   28    8    5   64   65                                       
CONECT   29    7    9    8                                            
CONECT   30   32   32   31    2                                       
CONECT   31   30   35   35    6                                       
CONECT   32   33   30   30   66                                       
CONECT   33   34   34   32   67                                       
CONECT   34   33   33   35   68                                       
CONECT   35   34   31   31   36                                       
CONECT   36   35   69   70   71                                       
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   16                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   20                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   24                                                      
CONECT   63   25                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
CONECT   69   36                                                      
CONECT   70   36                                                      
CONECT   71   36                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
