COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.350  -2.478   0.612  1.00  0.00           C  
HETATM    2  C   UNL     1       0.792  -3.935   0.347  1.00  0.00           C  
HETATM    3  C   UNL     1       2.252  -4.045   0.569  1.00  0.00           C  
HETATM    4  C   UNL     1       3.111  -3.213  -0.372  1.00  0.00           C  
HETATM    5  C   UNL     1       3.251  -1.805   0.167  1.00  0.00           C  
HETATM    6  C   UNL     1       5.720  -2.172   0.285  1.00  0.00           C  
HETATM    7  C   UNL     1       6.430   1.992   0.779  1.00  0.00           C  
HETATM    8  C   UNL     1       8.093   3.779   1.311  1.00  0.00           C  
HETATM    9  C   UNL     1       8.814   1.388   1.220  1.00  0.00           C  
HETATM   10  C   UNL     1       1.497   0.684  -2.211  1.00  0.00           C  
HETATM   11  C   UNL     1       2.519  -0.380  -1.795  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.391  -0.421  -0.395  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.451   0.851  -0.247  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.841   1.029  -0.862  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.085   0.426   0.503  1.00  0.00           C  
HETATM   16  C   UNL     1       2.001   0.291   0.507  1.00  0.00           C  
HETATM   17  C   UNL     1       4.797   0.149   0.356  1.00  0.00           C  
HETATM   18  C   UNL     1       6.251   0.594   0.184  1.00  0.00           C  
HETATM   19  C   UNL     1       7.884   2.436   0.607  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.238  -0.635  -1.020  1.00  0.00           C  
HETATM   21  C   UNL     1       0.100   0.067  -2.324  1.00  0.00           C  
HETATM   22  C   UNL     1       2.143  -0.918  -0.419  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.337   0.578  -0.917  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.497   1.769  -0.836  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.041  -0.500   1.083  1.00  0.00           C  
HETATM   26  C   UNL     1       0.790  -1.580  -0.469  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.699   0.243   1.115  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.184   0.690   1.165  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.272   1.512   0.523  1.00  0.00           C  
HETATM   30  C   UNL     1      -9.604   0.766   0.628  1.00  0.00           C  
HETATM   31  C   UNL     1       4.617  -1.249  -0.239  1.00  0.00           C  
HETATM   32  O   UNL     1       8.177   2.577  -0.785  1.00  0.00           O  
HETATM   33  O   UNL     1      -5.798  -0.009  -1.844  1.00  0.00           O  
HETATM   34  O   UNL     1      -5.411  -0.866   2.414  1.00  0.00           O  
HETATM   35  O   UNL     1     -10.635   1.546   0.019  1.00  0.00           O  
HETATM   36  H   UNL     1      -0.738  -2.443   0.684  1.00  0.00           H  
HETATM   37  H   UNL     1       0.780  -2.140   1.555  1.00  0.00           H  
HETATM   38  H   UNL     1       0.269  -4.605   1.029  1.00  0.00           H  
HETATM   39  H   UNL     1       0.559  -4.205  -0.683  1.00  0.00           H  
HETATM   40  H   UNL     1       2.468  -3.740   1.592  1.00  0.00           H  
HETATM   41  H   UNL     1       2.538  -5.091   0.456  1.00  0.00           H  
HETATM   42  H   UNL     1       4.098  -3.667  -0.458  1.00  0.00           H  
HETATM   43  H   UNL     1       2.642  -3.178  -1.355  1.00  0.00           H  
HETATM   44  H   UNL     1       3.172  -1.814   1.254  1.00  0.00           H  
HETATM   45  H   UNL     1       6.694  -1.732   0.072  1.00  0.00           H  
HETATM   46  H   UNL     1       5.606  -2.299   1.361  1.00  0.00           H  
HETATM   47  H   UNL     1       5.644  -3.142  -0.206  1.00  0.00           H  
HETATM   48  H   UNL     1       5.772   2.693   0.265  1.00  0.00           H  
HETATM   49  H   UNL     1       6.180   1.970   1.840  1.00  0.00           H  
HETATM   50  H   UNL     1       9.129   4.095   1.188  1.00  0.00           H  
HETATM   51  H   UNL     1       7.431   4.525   0.874  1.00  0.00           H  
HETATM   52  H   UNL     1       7.870   3.671   2.372  1.00  0.00           H  
HETATM   53  H   UNL     1       8.590   1.280   2.282  1.00  0.00           H  
HETATM   54  H   UNL     1       8.665   0.432   0.719  1.00  0.00           H  
HETATM   55  H   UNL     1       9.850   1.705   1.098  1.00  0.00           H  
HETATM   56  H   UNL     1       1.481   1.479  -1.465  1.00  0.00           H  
HETATM   57  H   UNL     1       1.786   1.101  -3.176  1.00  0.00           H  
HETATM   58  H   UNL     1       2.513  -1.194  -2.520  1.00  0.00           H  
HETATM   59  H   UNL     1       3.513   0.066  -1.753  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.635  -0.982   0.496  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.640   1.729  -1.105  1.00  0.00           H  
HETATM   62  H   UNL     1       2.905   0.897   0.454  1.00  0.00           H  
HETATM   63  H   UNL     1       1.144   0.888   0.197  1.00  0.00           H  
HETATM   64  H   UNL     1       1.853  -0.051   1.532  1.00  0.00           H  
HETATM   65  H   UNL     1       4.547   0.127   1.417  1.00  0.00           H  
HETATM   66  H   UNL     1       4.139   0.850  -0.158  1.00  0.00           H  
HETATM   67  H   UNL     1       6.501   0.615  -0.877  1.00  0.00           H  
HETATM   68  H   UNL     1       6.908  -0.107   0.698  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.631   0.851  -2.516  1.00  0.00           H  
HETATM   70  H   UNL     1       0.086  -0.656  -3.140  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.125   1.090  -1.844  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.586   2.665  -0.222  1.00  0.00           H  
HETATM   73  H   UNL     1      -4.212   2.045  -1.852  1.00  0.00           H  
HETATM   74  H   UNL     1      -4.961  -1.394   0.466  1.00  0.00           H  
HETATM   75  H   UNL     1       0.911  -2.274  -1.300  1.00  0.00           H  
HETATM   76  H   UNL     1      -2.898  -0.457   1.354  1.00  0.00           H  
HETATM   77  H   UNL     1      -3.735   1.032   1.866  1.00  0.00           H  
HETATM   78  H   UNL     1      -7.311   0.318   2.171  1.00  0.00           H  
HETATM   79  H   UNL     1      -8.352   2.471   1.034  1.00  0.00           H  
HETATM   80  H   UNL     1      -8.030   1.678  -0.526  1.00  0.00           H  
HETATM   81  H   UNL     1      -9.524  -0.193   0.116  1.00  0.00           H  
HETATM   82  H   UNL     1      -9.846   0.600   1.677  1.00  0.00           H  
HETATM   83  H   UNL     1       4.677  -1.192  -1.326  1.00  0.00           H  
HETATM   84  H   UNL     1       9.084   2.858  -0.969  1.00  0.00           H  
HETATM   85  H   UNL     1      -5.635   0.307  -2.743  1.00  0.00           H  
HETATM   86  H   UNL     1      -4.783  -1.461   2.847  1.00  0.00           H  
HETATM   87  H   UNL     1     -11.509   1.133   0.049  1.00  0.00           H  
CONECT    1   26    2   36   37                                       
CONECT    2    1    3   38   39                                       
CONECT    3    4    2   40   41                                       
CONECT    4    5    3   42   43                                       
CONECT    5   31   22    4   44                                       
CONECT    6   31   45   46   47                                       
CONECT    7   19   18   48   49                                       
CONECT    8   19   50   51   52                                       
CONECT    9   19   53   54   55                                       
CONECT   10   11   21   56   57                                       
CONECT   11   22   10   58   59                                       
CONECT   12   23   20   20   60                                       
CONECT   13   27   24   23   23                                       
CONECT   14   15   24   33   61                                       
CONECT   15   28   28   25   14                                       
CONECT   16   22   62   63   64                                       
CONECT   17   18   31   65   66                                       
CONECT   18    7   17   67   68                                       
CONECT   19    9    8    7   32                                       
CONECT   20   26   12   12   21                                       
CONECT   21   10   20   69   70                                       
CONECT   22   16    5   11   26                                       
CONECT   23   13   13   12   71                                       
CONECT   24   13   14   72   73                                       
CONECT   25   34   27   15   74                                       
CONECT   26   22   20    1   75                                       
CONECT   27   13   25   76   77                                       
CONECT   28   29   15   15   78                                       
CONECT   29   30   28   79   80                                       
CONECT   30   35   29   81   82                                       
CONECT   31   17    6    5   83                                       
CONECT   32   19   84                                                 
CONECT   33   14   85                                                 
CONECT   34   25   86                                                 
CONECT   35   30   87                                                 
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43    4                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    8                                                      
CONECT   52    8                                                      
CONECT   53    9                                                      
CONECT   54    9                                                      
CONECT   55    9                                                      
CONECT   56   10                                                      
CONECT   57   10                                                      
CONECT   58   11                                                      
CONECT   59   11                                                      
CONECT   60   12                                                      
CONECT   61   14                                                      
CONECT   62   16                                                      
CONECT   63   16                                                      
CONECT   64   16                                                      
CONECT   65   17                                                      
CONECT   66   17                                                      
CONECT   67   18                                                      
CONECT   68   18                                                      
CONECT   69   21                                                      
CONECT   70   21                                                      
CONECT   71   23                                                      
CONECT   72   24                                                      
CONECT   73   24                                                      
CONECT   74   25                                                      
CONECT   75   26                                                      
CONECT   76   27                                                      
CONECT   77   27                                                      
CONECT   78   28                                                      
CONECT   79   29                                                      
CONECT   80   29                                                      
CONECT   81   30                                                      
CONECT   82   30                                                      
CONECT   83   31                                                      
CONECT   84   32                                                      
CONECT   85   33                                                      
CONECT   86   34                                                      
CONECT   87   35                                                      
MASTER        0    0    0    0    0    0    0    0   87    0   87    0
END
