COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.297   0.917   0.209  1.00  0.00           O  
HETATM    2  C   UNL     1       4.052   2.246   0.676  1.00  0.00           C  
HETATM    3  C   UNL     1       3.464   3.091  -0.458  1.00  0.00           C  
HETATM    4  C   UNL     1       2.114   2.546  -0.847  1.00  0.00           C  
HETATM    5  C   UNL     1       1.893   2.107  -2.140  1.00  0.00           C  
HETATM    6  C   UNL     1       0.657   1.607  -2.499  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.364   1.545  -1.561  1.00  0.00           C  
HETATM    8  O   UNL     1      -1.581   1.053  -1.912  1.00  0.00           O  
HETATM    9  C   UNL     1      -2.405   1.120  -0.746  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.798   0.578  -1.074  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.680   0.649   0.174  1.00  0.00           C  
HETATM   12  O   UNL     1      -5.981   0.143  -0.133  1.00  0.00           O  
HETATM   13  C   UNL     1      -6.753   0.235   1.066  1.00  0.00           C  
HETATM   14  C   UNL     1      -8.143  -0.285   0.809  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.427  -1.624   1.004  1.00  0.00           C  
HETATM   16  C   UNL     1      -9.703  -2.102   0.769  1.00  0.00           C  
HETATM   17  C   UNL     1     -10.695  -1.241   0.339  1.00  0.00           C  
HETATM   18  C   UNL     1      -9.137   0.577   0.384  1.00  0.00           C  
HETATM   19  C   UNL     1     -10.411   0.098   0.144  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.142   1.991  -0.267  1.00  0.00           C  
HETATM   21  C   UNL     1       1.099   2.485   0.089  1.00  0.00           C  
HETATM   22  C   UNL     1       3.314   4.538   0.024  1.00  0.00           C  
HETATM   23  C   UNL     1       4.668   5.045   0.524  1.00  0.00           C  
HETATM   24  N   UNL     1       5.118   4.226   1.655  1.00  0.00           N  
HETATM   25  C   UNL     1       5.366   2.874   1.143  1.00  0.00           C  
HETATM   26  C   UNL     1       4.151   0.050   1.335  1.00  0.00           C  
HETATM   27  C   UNL     1       4.398  -1.374   0.908  1.00  0.00           C  
HETATM   28  C   UNL     1       3.356  -2.135   0.477  1.00  0.00           C  
HETATM   29  C   UNL     1       5.690  -1.893   0.966  1.00  0.00           C  
HETATM   30  C   UNL     1       5.948  -3.175   0.588  1.00  0.00           C  
HETATM   31  C   UNL     1       4.898  -3.990   0.132  1.00  0.00           C  
HETATM   32  C   UNL     1       5.125  -5.318  -0.267  1.00  0.00           C  
HETATM   33  C   UNL     1       4.083  -6.077  -0.703  1.00  0.00           C  
HETATM   34  C   UNL     1       3.584  -3.461   0.073  1.00  0.00           C  
HETATM   35  C   UNL     1       2.534  -4.276  -0.383  1.00  0.00           C  
HETATM   36  C   UNL     1       2.791  -5.558  -0.761  1.00  0.00           C  
HETATM   37  H   UNL     1       3.347   2.215   1.507  1.00  0.00           H  
HETATM   38  H   UNL     1       4.132   3.061  -1.319  1.00  0.00           H  
HETATM   39  H   UNL     1       2.689   2.156  -2.869  1.00  0.00           H  
HETATM   40  H   UNL     1       0.485   1.264  -3.508  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.486   2.156  -0.417  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.960   0.520   0.048  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.716  -0.458  -1.403  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.243   1.177  -1.869  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.235   0.050   0.968  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.761   1.685   0.503  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.281  -0.359   1.849  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.808   1.277   1.384  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.652  -2.297   1.341  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.924  -3.148   0.921  1.00  0.00           H  
HETATM   51  H   UNL     1     -11.691  -1.614   0.154  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.915   1.623   0.232  1.00  0.00           H  
HETATM   53  H   UNL     1     -11.186   0.771  -0.192  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.934   1.944   0.465  1.00  0.00           H  
HETATM   55  H   UNL     1       1.274   2.828   1.098  1.00  0.00           H  
HETATM   56  H   UNL     1       2.972   5.163  -0.801  1.00  0.00           H  
HETATM   57  H   UNL     1       2.588   4.577   0.836  1.00  0.00           H  
HETATM   58  H   UNL     1       5.398   4.982  -0.283  1.00  0.00           H  
HETATM   59  H   UNL     1       4.571   6.082   0.843  1.00  0.00           H  
HETATM   60  H   UNL     1       6.012   4.596   1.943  1.00  0.00           H  
HETATM   61  H   UNL     1       6.060   2.926   0.304  1.00  0.00           H  
HETATM   62  H   UNL     1       5.800   2.262   1.934  1.00  0.00           H  
HETATM   63  H   UNL     1       4.871   0.329   2.105  1.00  0.00           H  
HETATM   64  H   UNL     1       3.140   0.140   1.734  1.00  0.00           H  
HETATM   65  H   UNL     1       2.359  -1.720   0.442  1.00  0.00           H  
HETATM   66  H   UNL     1       6.499  -1.269   1.316  1.00  0.00           H  
HETATM   67  H   UNL     1       6.954  -3.564   0.638  1.00  0.00           H  
HETATM   68  H   UNL     1       6.121  -5.734  -0.227  1.00  0.00           H  
HETATM   69  H   UNL     1       4.260  -7.098  -1.009  1.00  0.00           H  
HETATM   70  H   UNL     1       1.527  -3.887  -0.434  1.00  0.00           H  
HETATM   71  H   UNL     1       1.982  -6.182  -1.112  1.00  0.00           H  
CONECT    1    2   26                                                 
CONECT    2    1    3   25   37                                       
CONECT    3    2    4   22   38                                       
CONECT    4    3    5    5   21                                       
CONECT    5    4    4    6   39                                       
CONECT    6    5    7    7   40                                       
CONECT    7    6    6    8   20                                       
CONECT    8    7    9                                                 
CONECT    9    8   10   41   42                                       
CONECT   10    9   11   43   44                                       
CONECT   11   10   12   45   46                                       
CONECT   12   11   13                                                 
CONECT   13   12   14   47   48                                       
CONECT   14   13   15   15   18                                       
CONECT   15   14   14   16   49                                       
CONECT   16   15   17   17   50                                       
CONECT   17   16   16   19   51                                       
CONECT   18   14   19   19   52                                       
CONECT   19   17   18   18   53                                       
CONECT   20    7   21   21   54                                       
CONECT   21    4   20   20   55                                       
CONECT   22    3   23   56   57                                       
CONECT   23   22   24   58   59                                       
CONECT   24   23   25   60                                            
CONECT   25    2   24   61   62                                       
CONECT   26    1   27   63   64                                       
CONECT   27   26   28   28   29                                       
CONECT   28   27   27   34   65                                       
CONECT   29   27   30   30   66                                       
CONECT   30   29   29   31   67                                       
CONECT   31   30   32   32   34                                       
CONECT   32   31   31   33   68                                       
CONECT   33   32   36   36   69                                       
CONECT   34   28   31   35   35                                       
CONECT   35   34   34   36   70                                       
CONECT   36   33   33   35   71                                       
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   26                                                      
CONECT   65   28                                                      
CONECT   66   29                                                      
CONECT   67   30                                                      
CONECT   68   32                                                      
CONECT   69   33                                                      
CONECT   70   35                                                      
CONECT   71   36                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
