********************* Core Excitation Data ******************** **************** A.P. Hitchcock & D.C. Mancini **************** * * Formula: c-C6F5H * Name: Pentafluorobenzene * Edge: C 1s * Alpha Formula: C6F5H * Data Source: Hitchcock * Filename: pf-0cckk.os * Ref. Code: HF&87 * Write Date: 93/06/10 * Reference: J. Phys. Chem. 91 (87) 531. * Source and Purity: (borrowed) * Acquisition Mode: EELS, 2 deg., 2500 eV CRE, 0.7 eV fwhm *-------------------------------------------------------------- * No. of Spectra: 2 name1- 0pfc1 0pfc.os * E (eV) Raw data Osc. Str. per atom (E-2) *-------------------------------------------------------------- 2.819870E+02 9.233000E+03 -5.645346E-03 2.821440E+02 9.377000E+03 5.368885E-03 2.823010E+02 9.646000E+03 2.529986E-02 2.824580E+02 9.293000E+03 8.533476E-04 2.826160E+02 9.078000E+03 -1.374420E-02 2.827730E+02 9.266000E+03 4.042393E-04 2.829300E+02 9.115000E+03 -9.634438E-03 2.830870E+02 9.267000E+03 1.943163E-03 2.832450E+02 9.205000E+03 -1.743622E-03 2.834020E+02 9.054000E+03 -1.178585E-02 2.835590E+02 9.155000E+03 -3.850585E-03 2.837160E+02 9.117000E+03 -5.833322E-03 2.838740E+02 9.159000E+03 -2.105152E-03 2.840310E+02 9.369000E+03 1.360312E-02 2.841880E+02 9.048000E+03 -8.573884E-03 2.843450E+02 9.304000E+03 1.041386E-02 2.845020E+02 9.389000E+03 1.720044E-02 2.846600E+02 9.928000E+03 5.638079E-02 2.848170E+02 1.074700E+04 1.155317E-01 2.849740E+02 1.198100E+04 2.042896E-01 2.851310E+02 1.325200E+04 2.956860E-01 2.852890E+02 1.444500E+04 3.815210E-01 2.854460E+02 1.484500E+04 4.107741E-01 2.856030E+02 1.463400E+04 3.964341E-01 2.857600E+02 1.430000E+04 3.733179E-01 2.859170E+02 1.411500E+04 3.608306E-01 2.860750E+02 1.386400E+04 3.436381E-01 2.862320E+02 1.471700E+04 4.052042E-01 2.863890E+02 1.586300E+04 4.876731E-01 2.865460E+02 1.711600E+04 5.777748E-01 2.867040E+02 1.845600E+04 6.740867E-01 2.868610E+02 2.033200E+04 8.086336E-01 2.870180E+02 2.531500E+04 1.164847E+00 2.871750E+02 3.429500E+04 1.806223E+00 2.873330E+02 4.858900E+04 2.826728E+00 2.874900E+02 6.499200E+04 3.997692E+00 2.876470E+02 7.759500E+04 4.897545E+00 2.878040E+02 8.293100E+04 5.278937E+00 2.879610E+02 8.039200E+04 5.098491E+00 2.881190E+02 7.130800E+04 4.451096E+00 2.882760E+02 6.146200E+04 3.749332E+00 2.884330E+02 5.239500E+04 3.103144E+00 2.885900E+02 4.525200E+04 2.594222E+00 2.887480E+02 4.058700E+04 2.262096E+00 2.889050E+02 3.657600E+04 1.976622E+00 2.890620E+02 3.405600E+04 1.797522E+00 2.892190E+02 3.076100E+04 1.563130E+00 2.893760E+02 2.787200E+04 1.357702E+00 2.895340E+02 2.471600E+04 1.133228E+00 2.896910E+02 2.180800E+04 9.264422E-01 2.898480E+02 1.987600E+04 7.892874E-01 2.900050E+02 1.860900E+04 6.995759E-01 2.901630E+02 1.853600E+04 6.950526E-01 2.903200E+02 1.998000E+04 7.987539E-01 2.904770E+02 2.276600E+04 9.981981E-01 2.906340E+02 2.662800E+04 1.274408E+00 2.907920E+02 3.034300E+04 1.540134E+00 2.909490E+02 3.209300E+04 1.665662E+00 2.911060E+02 3.310500E+04 1.738537E+00 2.912630E+02 3.365500E+04 1.778449E+00 2.914200E+02 3.409200E+04 1.810299E+00 2.915780E+02 3.422100E+04 1.820177E+00 2.917350E+02 3.424000E+04 1.822203E+00 2.918920E+02 3.513700E+04 1.886867E+00 2.920490E+02 3.536100E+04 1.903516E+00 2.922070E+02 3.613500E+04 1.959408E+00 2.923640E+02 3.669900E+04 2.000312E+00 2.925210E+02 3.679700E+04 2.007968E+00 2.926780E+02 3.694500E+04 2.019190E+00 2.928350E+02 3.748400E+04 2.058307E+00 2.929930E+02 3.800600E+04 2.096214E+00 2.931500E+02 3.901600E+04 2.168932E+00 2.933070E+02 3.905000E+04 2.172017E+00 2.934640E+02 3.889700E+04 2.161759E+00 2.936220E+02 3.919500E+04 2.183681E+00 2.937790E+02 3.951800E+04 2.207381E+00 2.939360E+02 3.963100E+04 2.216098E+00 2.940930E+02 3.956200E+04 2.211828E+00 2.942500E+02 3.973300E+04 2.224681E+00 2.944080E+02 4.000800E+04 2.244957E+00 2.945650E+02 3.980600E+04 2.231196E+00 2.947220E+02 3.988600E+04 2.237553E+00 2.948790E+02 3.983100E+04 2.234278E+00 2.950370E+02 4.021000E+04 2.261970E+00 2.951940E+02 4.153500E+04 2.357147E+00 2.953510E+02 4.233500E+04 2.414868E+00 2.955080E+02 4.353900E+04 2.501411E+00 2.956660E+02 4.478900E+04 2.591239E+00 2.958230E+02 4.572400E+04 2.658589E+00 2.959800E+02 4.547900E+04 2.641751E+00 2.961370E+02 4.557600E+04 2.649312E+00 2.962940E+02 4.452500E+04 2.574968E+00 2.964520E+02 4.359300E+04 2.509117E+00 2.966090E+02 4.275500E+04 2.449967E+00 2.967660E+02 4.191000E+04 2.390318E+00 2.969230E+02 4.052900E+04 2.292426E+00 2.970810E+02 4.013400E+04 2.264883E+00 2.972380E+02 3.973400E+04 2.236979E+00 2.973950E+02 3.958500E+04 2.226980E+00 2.975520E+02 3.981400E+04 2.243949E+00 2.977090E+02 3.941600E+04 2.216185E+00 2.978670E+02 3.965000E+04 2.233513E+00 2.980240E+02 3.998000E+04 2.257684E+00 2.981810E+02 4.052900E+04 2.297479E+00 2.983380E+02 4.129900E+04 2.353041E+00 2.984960E+02 4.183700E+04 2.392054E+00 2.986530E+02 4.238300E+04 2.431632E+00 2.988100E+02 4.299600E+04 2.475989E+00 2.989670E+02 4.305100E+04 2.480536E+00 2.991250E+02 4.308900E+04 2.483871E+00 2.992820E+02 4.316300E+04 2.489771E+00 2.994390E+02 4.309800E+04 2.485753E+00 2.995960E+02 4.217800E+04 2.420735E+00 2.997530E+02 4.210800E+04 2.416358E+00 2.999110E+02 4.140900E+04 2.367108E+00 3.000680E+02 4.052600E+04 2.304726E+00 3.002250E+02 4.002100E+04 2.269312E+00 3.003820E+02 3.923900E+04 2.214134E+00 3.005400E+02 3.845500E+04 2.158816E+00 3.006970E+02 3.771700E+04 2.106776E+00 3.008540E+02 3.705500E+04 2.060156E+00 3.010110E+02 3.619000E+04 1.999053E+00 3.011680E+02 3.532500E+04 1.937948E+00 3.013260E+02 3.507400E+04 1.920652E+00 3.014830E+02 3.453500E+04 1.882804E+00 3.016400E+02 3.375400E+04 1.827690E+00 3.017970E+02 3.377700E+04 1.829936E+00 3.019550E+02 3.342800E+04 1.805644E+00 3.021120E+02 3.331300E+04 1.798042E+00 3.022690E+02 3.310600E+04 1.783876E+00 3.024260E+02 3.322300E+04 1.792825E+00 3.025830E+02 3.338500E+04 1.804983E+00 3.027410E+02 3.308800E+04 1.784396E+00 3.028980E+02 3.361900E+04 1.822878E+00 3.030550E+02 3.344700E+04 1.811205E+00 3.032120E+02 3.379700E+04 1.836772E+00 3.033700E+02 3.367000E+04 1.828310E+00 3.035270E+02 3.408000E+04 1.858157E+00 3.036840E+02 3.387600E+04 1.844195E+00 3.038410E+02 3.420300E+04 1.868118E+00 3.039990E+02 3.426100E+04 1.872851E+00 3.041560E+02 3.406900E+04 1.859744E+00 3.043130E+02 3.427000E+04 1.874674E+00 3.044700E+02 3.423600E+04 1.872838E+00 3.046270E+02 3.458100E+04 1.898040E+00 3.047850E+02 3.446300E+04 1.890212E+00 3.049420E+02 3.403900E+04 1.860548E+00 3.050990E+02 3.385300E+04 1.847864E+00 3.052560E+02 3.366800E+04 1.835249E+00 3.054140E+02 3.383300E+04 1.847608E+00 3.055710E+02 3.337600E+04 1.815587E+00 3.057280E+02 3.287400E+04 1.780353E+00 3.058850E+02 3.266000E+04 1.765666E+00 3.060420E+02 3.234900E+04 1.744058E+00 3.062000E+02 3.175800E+04 1.702477E+00 3.063570E+02 3.126400E+04 1.667811E+00 3.065140E+02 3.089500E+04 1.642062E+00 3.066710E+02 3.065200E+04 1.625302E+00 3.068290E+02 3.017100E+04 1.591564E+00 3.069860E+02 2.992400E+04 1.574517E+00 3.071430E+02 2.975500E+04 1.563033E+00 3.073000E+02 2.922000E+04 1.525436E+00 3.074580E+02 2.863200E+04 1.484062E+00 3.076150E+02 2.822200E+04 1.455382E+00 3.077720E+02 2.799900E+04 1.440042E+00 3.079290E+02 2.804700E+04 1.444036E+00 3.080860E+02 2.740000E+04 1.398445E+00 3.082440E+02 2.653300E+04 1.337160E+00 3.084010E+02 2.665600E+04 1.346502E+00 3.085580E+02 2.633600E+04 1.324238E+00 3.087150E+02 2.596100E+04 1.298049E+00 3.088730E+02 2.587700E+04 1.292624E+00 3.090300E+02 2.533200E+04 1.254304E+00 3.091870E+02 2.514100E+04 1.241239E+00 3.093440E+02 2.486100E+04 1.221825E+00 3.095010E+02 2.481600E+04 1.219175E+00 3.096590E+02 2.405300E+04 1.165302E+00 3.098160E+02 2.408700E+04 1.168287E+00 3.099730E+02 2.408400E+04 1.168631E+00 3.101300E+02 2.383500E+04 1.151424E+00 3.102880E+02 2.358900E+04 1.134433E+00 3.104450E+02 2.286000E+04 1.082979E+00 3.106020E+02 2.288200E+04 1.078753E+00 3.107590E+02 2.272600E+04 1.074527E+00 3.109170E+02 2.268400E+04 1.072087E+00 3.110740E+02 2.235300E+04 1.049025E+00 3.112310E+02 2.225100E+04 1.042299E+00 3.113880E+02 2.202900E+04 1.027011E+00 3.115450E+02 2.197700E+04 1.023851E+00 3.117030E+02 2.176000E+04 1.008921E+00 3.118600E+02 2.147000E+04 9.887793E-01 3.120170E+02 2.180700E+04 1.013370E+00 3.121740E+02 2.126300E+04 9.751050E-01 3.123320E+02 2.113000E+04 9.661651E-01 3.124890E+02 2.114200E+04 9.675661E-01 3.126460E+02 2.080600E+04 9.441382E-01 3.128030E+02 2.121000E+04 9.735045E-01 3.129600E+02 2.074800E+04 9.410855E-01 3.131180E+02 2.087700E+04 9.508340E-01 3.132750E+02 2.065100E+04 9.352508E-01 3.134320E+02 2.042400E+04 9.195954E-01 3.135890E+02 2.070700E+04 9.403248E-01 3.137470E+02 2.043400E+04 9.213898E-01 3.139040E+02 2.027100E+04 9.102979E-01 3.140610E+02 2.042300E+04 9.216786E-01 3.142180E+02 2.023300E+04 9.086590E-01 3.143750E+02 2.012900E+04 9.017742E-01 3.145330E+02 2.005000E+04 8.966756E-01 3.146900E+02 2.016500E+04 9.054137E-01 3.148470E+02 1.986600E+04 8.846145E-01 3.150040E+02 1.974200E+04 8.762992E-01 3.151620E+02 1.972900E+04 8.759063E-01 3.153190E+02 1.968400E+04 8.732260E-01 3.154760E+02 1.964700E+04 8.711155E-01 3.156330E+02 1.960500E+04 8.686476E-01 3.157910E+02 1.935900E+04 8.516281E-01 3.159480E+02 1.948600E+04 8.612161E-01 3.161050E+02 1.927300E+04 8.465460E-01 3.162620E+02 1.905900E+04 8.318035E-01 3.164190E+02 1.911200E+04 8.361096E-01 3.165770E+02 1.918200E+04 8.416307E-01 3.167340E+02 1.884300E+04 8.179682E-01 3.168910E+02 1.912600E+04 8.386813E-01 3.170480E+02 1.934600E+04 8.548986E-01 3.172060E+02 1.908300E+04 8.366588E-01 3.173630E+02 1.883300E+04 8.193427E-01 3.175200E+02 1.874900E+04 8.138689E-01 3.176770E+02 1.879800E+04 8.178833E-01 3.178340E+02 1.896300E+04 8.301730E-01 3.179920E+02 1.883100E+04 8.212756E-01 3.181490E+02 1.866800E+04 8.101627E-01 3.183060E+02 1.882800E+04 8.220932E-01 3.184630E+02 1.867000E+04 8.113356E-01 3.186210E+02 1.863400E+04 8.092842E-01 3.187780E+02 1.818100E+04 7.774782E-01 3.189350E+02 1.819100E+04 7.787039E-01 3.190920E+02 1.837400E+04 7.922716E-01 3.192500E+02 1.828600E+04 7.865072E-01 3.194070E+02 1.865000E+04 8.129869E-01 3.195640E+02 1.834700E+04 7.918786E-01 3.197210E+02 1.837700E+04 7.945278E-01 3.198780E+02 1.824000E+04 7.852613E-01 3.200360E+02 1.844100E+04 8.001119E-01 3.201930E+02 1.846400E+04 8.022591E-01 3.203500E+02 1.823000E+04 7.860702E-01 3.205070E+02 1.811000E+04 7.780133E-01 3.206650E+02 1.837100E+04 7.971416E-01 3.208220E+02 1.804600E+04 7.744582E-01 3.209790E+02 1.820100E+04 7.860188E-01 3.211360E+02 1.805400E+04 7.760331E-01 3.212930E+02 1.803000E+04 7.748221E-01 3.214510E+02 1.811100E+04 7.811046E-01 3.216080E+02 1.801900E+04 7.750405E-01 3.217650E+02 1.807200E+04 7.793207E-01 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7.845672E-01 3.260100E+02 1.766900E+04 7.637863E-01 3.261670E+02 1.771100E+04 7.672616E-01 3.263250E+02 1.769600E+04 7.666729E-01 3.264820E+02 1.740600E+04 7.464606E-01 3.266390E+02 1.785600E+04 7.790425E-01 3.267960E+02 1.762100E+04 7.627525E-01 3.269540E+02 1.760600E+04 7.621611E-01 3.271110E+02 1.746500E+04 7.525763E-01 3.272680E+02 1.763900E+04 7.654642E-01 3.274250E+02 1.755900E+04 7.602299E-01 3.275830E+02 1.764000E+04 7.664849E-01 3.277400E+02 1.742700E+04 7.517607E-01 3.278970E+02 1.747700E+04 7.557991E-01