COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.410  -0.415  -1.360  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.089  -0.375  -1.800  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.944   1.329   0.220  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.600   1.362  -0.227  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.352   2.202   1.241  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.454   3.067   1.787  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.132   3.100   1.348  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.701   2.268   0.360  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.192   0.491  -1.252  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.768   0.515  -1.744  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.845   0.419  -0.369  1.00  0.00           C  
HETATM   12  C   UNL     1      -8.991  -0.576  -0.600  1.00  0.00           C  
HETATM   13  O   UNL     1      -8.138   0.371   0.045  1.00  0.00           O  
HETATM   14  N   UNL     1      -1.917  -0.241  -0.815  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.489  -0.043  -1.127  1.00  0.00           C  
HETATM   16  C   UNL     1       0.316  -0.933  -0.221  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.275  -1.666  -0.813  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.663  -2.355   0.415  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.206  -1.973   0.479  1.00  0.00           C  
HETATM   20  N   UNL     1       0.797  -2.527   1.175  1.00  0.00           N  
HETATM   21  C   UNL     1       0.662  -3.681   2.068  1.00  0.00           C  
HETATM   22  C   UNL     1       0.892  -4.969   1.275  1.00  0.00           C  
HETATM   23  O   UNL     1       0.761  -6.094   2.146  1.00  0.00           O  
HETATM   24  N   UNL     1       1.896  -1.895   0.943  1.00  0.00           N  
HETATM   25  C   UNL     1       1.683  -0.904   0.095  1.00  0.00           C  
HETATM   26  C   UNL     1       2.687   0.050  -0.419  1.00  0.00           C  
HETATM   27  O   UNL     1       2.354   0.922  -1.199  1.00  0.00           O  
HETATM   28  N   UNL     1       3.972  -0.046  -0.024  1.00  0.00           N  
HETATM   29  C   UNL     1       4.988   0.827  -0.616  1.00  0.00           C  
HETATM   30  C   UNL     1       6.355   0.146  -0.536  1.00  0.00           C  
HETATM   31  C   UNL     1       6.354  -1.087  -1.403  1.00  0.00           C  
HETATM   32  O   UNL     1       5.338  -1.435  -1.957  1.00  0.00           O  
HETATM   33  O   UNL     1       7.482  -1.798  -1.559  1.00  0.00           O  
HETATM   34  C   UNL     1       5.031   2.131   0.139  1.00  0.00           C  
HETATM   35  C   UNL     1       4.920   2.136   1.516  1.00  0.00           C  
HETATM   36  C   UNL     1       4.960   3.332   2.209  1.00  0.00           C  
HETATM   37  C   UNL     1       5.110   4.523   1.523  1.00  0.00           C  
HETATM   38  C   UNL     1       5.222   4.518   0.145  1.00  0.00           C  
HETATM   39  C   UNL     1       5.187   3.321  -0.547  1.00  0.00           C  
HETATM   40  H   UNL     1      -7.100  -1.112  -1.812  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.771  -1.042  -2.587  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.374   2.188   1.591  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.770   3.737   2.572  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.439   3.796   1.797  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.673   2.305   0.030  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.717   0.062  -2.734  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.420   1.547  -1.798  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.033  -0.360  -1.667  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.598  -1.582  -0.448  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.993  -0.510  -0.176  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.300  -0.310  -2.167  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.217   0.998  -0.958  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.360  -1.766  -0.782  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.894  -2.136  -1.720  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.172  -2.019   1.318  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.758  -3.436   0.317  1.00  0.00           H  
HETATM   57  H   UNL     1       1.400  -3.610   2.867  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.339  -3.693   2.498  1.00  0.00           H  
HETATM   59  H   UNL     1       0.154  -5.040   0.476  1.00  0.00           H  
HETATM   60  H   UNL     1       1.893  -4.957   0.845  1.00  0.00           H  
HETATM   61  H   UNL     1       0.894  -6.947   1.710  1.00  0.00           H  
HETATM   62  H   UNL     1       4.224  -0.694   0.653  1.00  0.00           H  
HETATM   63  H   UNL     1       4.738   1.020  -1.660  1.00  0.00           H  
HETATM   64  H   UNL     1       7.125   0.835  -0.885  1.00  0.00           H  
HETATM   65  H   UNL     1       6.561  -0.136   0.496  1.00  0.00           H  
HETATM   66  H   UNL     1       7.431  -2.581  -2.125  1.00  0.00           H  
HETATM   67  H   UNL     1       4.802   1.206   2.052  1.00  0.00           H  
HETATM   68  H   UNL     1       4.872   3.336   3.285  1.00  0.00           H  
HETATM   69  H   UNL     1       5.141   5.457   2.064  1.00  0.00           H  
HETATM   70  H   UNL     1       5.339   5.448  -0.391  1.00  0.00           H  
HETATM   71  H   UNL     1       5.278   3.317  -1.623  1.00  0.00           H  
CONECT    1   11   11    2   40                                       
CONECT    2    9    9    1   41                                       
CONECT    3    5    5    4   11                                       
CONECT    4    8    8    3    9                                       
CONECT    5    6    3    3   42                                       
CONECT    6    7    7    5   43                                       
CONECT    7    6    6    8   44                                       
CONECT    8    7    4    4   45                                       
CONECT    9    4   10    2    2                                       
CONECT   10   14    9   46   47                                       
CONECT   11    3   13    1    1                                       
CONECT   12   13   48   49   50                                       
CONECT   13   11   12                                                 
CONECT   14   17   10   15                                            
CONECT   15   14   16   51   52                                       
CONECT   16   19   19   15   25                                       
CONECT   17   18   14   53   54                                       
CONECT   18   17   19   55   56                                       
CONECT   19   18   20   16   16                                       
CONECT   20   21   19   24                                            
CONECT   21   22   20   57   58                                       
CONECT   22   23   21   59   60                                       
CONECT   23   22   61                                                 
CONECT   24   20   25   25                                            
CONECT   25   16   24   24   26                                       
CONECT   26   25   27   27   28                                       
CONECT   27   26   26                                                 
CONECT   28   26   29   62                                            
CONECT   29   28   30   34   63                                       
CONECT   30   31   29   64   65                                       
CONECT   31   32   32   30   33                                       
CONECT   32   31   31                                                 
CONECT   33   31   66                                                 
CONECT   34   29   35   35   39                                       
CONECT   35   34   34   36   67                                       
CONECT   36   35   37   37   68                                       
CONECT   37   36   36   38   69                                       
CONECT   38   39   39   37   70                                       
CONECT   39   34   38   38   71                                       
CONECT   40    1                                                      
CONECT   41    2                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   30                                                      
CONECT   66   33                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   37                                                      
CONECT   70   38                                                      
CONECT   71   39                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
