COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.972  -0.156  -0.097  1.00  0.00           N  
HETATM    2  N   UNL     1      -3.619   3.391   0.539  1.00  0.00           N1+
HETATM    3  C   UNL     1       5.865   0.789   0.109  1.00  0.00           C  
HETATM    4  C   UNL     1       4.532   0.051  -0.032  1.00  0.00           C  
HETATM    5  C   UNL     1       3.380   1.035   0.183  1.00  0.00           C  
HETATM    6  C   UNL     1       2.047   0.297   0.042  1.00  0.00           C  
HETATM    7  C   UNL     1       0.895   1.281   0.257  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.861   1.041   0.242  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.483   0.160   0.085  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.603  -1.542  -0.189  1.00  0.00           C  
HETATM   11  C   UNL     1     -10.455  -2.593  -1.588  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.432  -0.753  -0.009  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.129  -0.311   0.065  1.00  0.00           C  
HETATM   14  C   UNL     1       6.991  -1.181   0.954  1.00  0.00           C  
HETATM   15  C   UNL     1       9.426  -1.541   0.534  1.00  0.00           C  
HETATM   16  C   UNL     1       9.365  -0.445  -0.534  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.907   1.952   0.345  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.212   1.515   0.267  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.886  -0.312   0.001  1.00  0.00           C  
HETATM   20  C   UNL     1      -9.540  -2.710  -0.357  1.00  0.00           C  
HETATM   21  C   UNL     1     -11.452  -1.857  -0.678  1.00  0.00           C  
HETATM   22  C   UNL     1     -10.812  -2.609   0.501  1.00  0.00           C  
HETATM   23  C   UNL     1       8.258   0.549  -0.175  1.00  0.00           C  
HETATM   24  C   UNL     1       8.060  -2.227   0.628  1.00  0.00           C  
HETATM   25  C   UNL     1       8.179   1.635  -1.250  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.438   0.543   0.116  1.00  0.00           C  
HETATM   27  N   UNL     1      -1.541   1.485   0.322  1.00  0.00           N  
HETATM   28  N   UNL     1      -7.961   0.430   0.077  1.00  0.00           N  
HETATM   29  N   UNL     1      -7.294  -1.590  -0.174  1.00  0.00           N  
HETATM   30  O   UNL     1      10.619   0.238  -0.590  1.00  0.00           O  
HETATM   31  O   UNL     1       7.962   1.028  -2.525  1.00  0.00           O  
HETATM   32  O   UNL     1      -4.326   4.060   1.271  1.00  0.00           O  
HETATM   33  O   UNL     1      -2.675   3.905  -0.033  1.00  0.00           O1-
HETATM   34  O   UNL     1      -8.952  -0.261  -0.032  1.00  0.00           O  
HETATM   35  O   UNL     1       8.092  -3.213   1.662  1.00  0.00           O  
HETATM   36  O   UNL     1      10.420  -2.502   0.175  1.00  0.00           O  
HETATM   37  H   UNL     1       5.938   1.221   1.107  1.00  0.00           H  
HETATM   38  H   UNL     1       5.922   1.583  -0.636  1.00  0.00           H  
HETATM   39  H   UNL     1       4.460  -0.381  -1.030  1.00  0.00           H  
HETATM   40  H   UNL     1       4.476  -0.743   0.713  1.00  0.00           H  
HETATM   41  H   UNL     1       3.453   1.467   1.181  1.00  0.00           H  
HETATM   42  H   UNL     1       3.437   1.829  -0.562  1.00  0.00           H  
HETATM   43  H   UNL     1       1.975  -0.135  -0.956  1.00  0.00           H  
HETATM   44  H   UNL     1       1.991  -0.496   0.787  1.00  0.00           H  
HETATM   45  H   UNL     1       0.967   1.713   1.255  1.00  0.00           H  
HETATM   46  H   UNL     1       0.951   2.075  -0.488  1.00  0.00           H  
HETATM   47  H   UNL     1     -10.043  -1.969  -2.380  1.00  0.00           H  
HETATM   48  H   UNL     1     -10.821  -3.553  -1.952  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.640  -1.803  -0.150  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.315  -1.017  -0.015  1.00  0.00           H  
HETATM   51  H   UNL     1       7.219  -0.715   1.912  1.00  0.00           H  
HETATM   52  H   UNL     1       6.015  -1.664   1.008  1.00  0.00           H  
HETATM   53  H   UNL     1       9.678  -1.097   1.497  1.00  0.00           H  
HETATM   54  H   UNL     1       9.151  -0.893  -1.504  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.024   2.224   0.340  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.034  -3.673  -0.279  1.00  0.00           H  
HETATM   57  H   UNL     1     -11.298  -0.778  -0.643  1.00  0.00           H  
HETATM   58  H   UNL     1     -12.492  -2.131  -0.858  1.00  0.00           H  
HETATM   59  H   UNL     1     -11.277  -3.573   0.708  1.00  0.00           H  
HETATM   60  H   UNL     1     -10.688  -1.997   1.394  1.00  0.00           H  
HETATM   61  H   UNL     1       8.479   1.008   0.789  1.00  0.00           H  
HETATM   62  H   UNL     1       7.825  -2.703  -0.323  1.00  0.00           H  
HETATM   63  H   UNL     1       7.355   2.312  -1.024  1.00  0.00           H  
HETATM   64  H   UNL     1       9.114   2.195  -1.269  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.511   0.111  -0.882  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.495  -0.250   0.861  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.354   2.417   0.513  1.00  0.00           H  
HETATM   68  H   UNL     1      11.368  -0.333  -0.809  1.00  0.00           H  
HETATM   69  H   UNL     1       7.901   1.659  -3.256  1.00  0.00           H  
HETATM   70  H   UNL     1       7.258  -3.689   1.778  1.00  0.00           H  
HETATM   71  H   UNL     1      10.514  -3.227   0.809  1.00  0.00           H  
CONECT    1   14    3   23                                            
CONECT    2   17   32   32   33                                       
CONECT    3    1    4   37   38                                       
CONECT    4    3    5   39   40                                       
CONECT    5    4    6   41   42                                       
CONECT    6    5    7   43   44                                       
CONECT    7   26    6   45   46                                       
CONECT    8   13   13   17   27                                       
CONECT    9   19   12   12   18                                       
CONECT   10   34   20   29   29                                       
CONECT   11   21   20   47   48                                       
CONECT   12    9    9   13   49                                       
CONECT   13   12    8    8   50                                       
CONECT   14   24    1   51   52                                       
CONECT   15   36   24   16   53                                       
CONECT   16   15   30   23   54                                       
CONECT   17   18   18    8    2                                       
CONECT   18    9   17   17   55                                       
CONECT   19   28   28   29    9                                       
CONECT   20   11   22   10   56                                       
CONECT   21   11   22   57   58                                       
CONECT   22   21   20   59   60                                       
CONECT   23   16    1   25   61                                       
CONECT   24   35   15   14   62                                       
CONECT   25   31   23   63   64                                       
CONECT   26   27    7   65   66                                       
CONECT   27    8   26   67                                            
CONECT   28   34   19   19                                            
CONECT   29   10   10   19                                            
CONECT   30   16   68                                                 
CONECT   31   25   69                                                 
CONECT   32    2    2                                                 
CONECT   33    2                                                      
CONECT   34   28   10                                                 
CONECT   35   24   70                                                 
CONECT   36   15   71                                                 
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   18                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   24                                                      
CONECT   63   25                                                      
CONECT   64   25                                                      
CONECT   65   26                                                      
CONECT   66   26                                                      
CONECT   67   27                                                      
CONECT   68   30                                                      
CONECT   69   31                                                      
CONECT   70   35                                                      
CONECT   71   36                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
