remarks file: xtallib/anom_mo.lib
remarks Atomic scattering factors with MoKa anomalous contribution.
remarks Library for X-PLOR(online)
remarks
remarks Authors: Paul Adams, Joe Jaeger, and Axel T. Brunger

!Note: the f' contribution has been added to the constant c
!
!BEWARE: 
!(1) element Cf has to be referred to as Cff 
!(2) element Sm has to be referred to as Smm 
!(3) types of elements with ionic state (i.e., +/-) specifications have 
!    to be put in double quotes in selection statements. 

set echo=false end
set message=off end

SCATter ( chemical "He" or chemical "HE" )
  0.873400 9.103700 0.630900 3.356800 0.311200 22.927601 0.178000 0.982100 0.006400
  FDP 0.000000
SCATter ( chemical "Li" or chemical "LI" )
  1.128200 3.954600 0.750800 1.052400 0.617500 85.390503 0.465300 168.261002 0.037700
  FDP 0.000000
SCATter ( chemical "Li+1" or chemical "LI+1" )
  0.696800 4.623700 0.788800 1.955700 0.341400 0.631600 0.156300 10.095300 0.016700
  FDP 0.000000
SCATter ( chemical "Be" or chemical "BE" )
  1.591900 43.642700 1.127800 1.862300 0.539100 103.483002 0.702900 0.542000 0.038500
  FDP 0.000000
SCATter ( chemical "Be+2" or chemical "BE+2" )
  6.260300 0.002700 0.884900 0.831300 0.799300 2.275800 0.164700 5.114600 -6.109200
  FDP 0.000000
SCATter ( chemical "B" )
  2.054500 23.218500 1.332600 1.021000 1.097900 60.349800 0.706800 0.140300 -0.193200
  FDP 0.001000
SCATter ( chemical C* and not 
        ( chem "Ca" or chem "CA" or chem "Ca+2" or chem "CA+2" or
          chem "Ce" or chem "CE" or chem "Ce+3" or chem "CE+3" or chem "Ce+4" or chem "CE+4" or
          chem "Co" or chem "CO" or chem "Co+2" or chem "CO+2" or chem "Co+3" or chem "CO+3" or
          chem "Cr" or chem "CR" or chem "Cr+2" or chem "CR+2" or chem "Cr+3" or chem "CR+3" or
          chem "Cu" or chem "CU" or chem "Cu+1" or chem "CU+1" or
          chem "Cd" or chem "CD" or chem "Cd+2" or chem "CD+2" or
          chem "Cs" or chem "CS" or chem "Cs+1" or chem "CS+1" or
          chem "Cm" or chem "CM" or
          chem "Cl" or chem "CL" or chem "Cl-1" or chem "CL-1" or
          chem "Cff" or chem "CFF" ))
  2.310000 20.843899 1.020000 10.207500 1.588600 0.568700 0.865000 51.651199 0.217600
  FDP 0.002000
SCATter ( chemical "Cv" or chemical "CV" )
  2.260690 22.690701 1.561650 0.656665 1.050750 9.756180 0.839259 55.594898 0.288977
  FDP 0.002000
SCATter ( chemical N* and not 
        ( chem "Ne" or chem "NE" or 
          chem "Na" or chem "NA" or chem "Na+1" or chem "NA+1" or 
          chem "Ni" or chem "NI" or chem "Ni+2" or chem "NI+2" or chem "Ni+3" or chem "NI+3" or
          chem "Nb" or chem "NB" or chem "Nb+3" or chem "NB+3" or chem "Nb+5" or chem "NB+5" or
          chem "Nd" or chem "ND" or chem "Nd+3" or chem "ND+3" or
          chem "Np" or chem "NP" or chem "Np+3" or chem "NP+3" or chem "Np+4" or chem "NP+4" or
          chem "Np+6" or chem "NP+6" ))
  12.212600 0.005700 3.132200 9.893300 2.012500 28.997499 1.166300 0.582600 -11.524999
  FDP 0.003000
SCATter ( chemical O* and not ( chem "Os" or chem "OS" or chem "Os+4" or chem "OS+4" ) )
  3.048500 13.277100 2.286800 5.701100 1.546300 0.323900 0.867000 32.908897 0.258800
  FDP 0.006000
SCATter ( chemical "O-1" or chemical "O-1" )
  4.191600 12.857300 1.639690 4.172360 1.526730 47.017899 -20.306999 -0.014040 21.949200
  FDP 0.006000
SCATter ( chemical "F" )
  3.539200 10.282499 2.641200 4.294400 1.517000 0.261500 1.024300 26.147600 0.291600
  FDP 0.010000
SCATter ( chemical "F-1" or chemical "F-1" )
  3.632200 5.277560 3.510570 14.735300 1.260640 0.442258 0.940706 47.343700 0.667396
  FDP 0.010000
SCATter ( chemical "Ne" or chemical "NE" )
  3.955300 8.404200 3.112500 3.426200 1.454600 0.230600 1.125100 21.718399 0.372500
  FDP 0.016000
SCATter ( chemical "Na" or chemical "NA" )
  4.762600 3.285000 3.173600 8.842199 1.267400 0.313600 1.112800 129.423996 0.706000
  FDP 0.025000
SCATter ( chemical "Na+1" or chemical "NA+1" )
  3.256500 2.667100 3.936200 6.115300 1.399800 0.200100 1.003200 14.039000 0.434000
  FDP 0.025000
SCATter ( chemical "Mg" or chemical "MG" )
  5.420400 2.827500 2.173500 79.261101 1.226900 0.380800 2.307300 7.193700 0.900400
  FDP 0.036000
SCATter ( chemical "Mg+2" or chemical "MG+2" )
  3.498800 2.167600 3.837800 4.754200 1.328400 0.185000 0.849700 10.141100 0.527300
  FDP 0.036000
SCATter ( chemical "Al" or chemical "AL" )
  6.420200 3.038700 1.900200 0.742600 1.593600 31.547199 1.964600 85.088600 1.171100
  FDP 0.052000
SCATter ( chemical "Al+3" or chemical "AL+3" )
  4.174480 1.938160 3.387600 4.145530 1.202960 0.228753 0.528137 8.285240 0.762786
  FDP 0.052000
SCATter ( chemical "Si" or chemical "SI" )
  6.291500 2.438600 3.035300 32.333698 1.989100 0.678500 1.541000 81.693695 1.212700
  FDP 0.071000
SCATter ( chemical "Siv" or chemical "SIV" )
  5.662690 2.665200 3.071640 38.663399 2.624460 0.916946 1.393200 93.545799 1.319070
  FDP 0.071000
SCATter ( chemical "Si+4" or chemical "SI+4" )
  4.439180 1.641670 3.203450 3.437570 1.194530 0.214900 0.416530 6.653650 0.818297
  FDP 0.071000
SCATter ( chemical P* and not (
          chem "Pd" or chem "Pr" or chem "Pm" or chem "Pt" or
          chem "Pb" or chem "Po" or chem "Pa" or chem "Pu" or
          chem "PD" or chem "PR" or chem "PM" or chem "PT" or
          chem "PB" or chem "PO" or chem "PA" or chem "PU" or
          chem "Pr+3" or chem "PR+3" or
          chem "Pr+4" or chem "PR+4" or 
          chem "Pm+3" or chem "PM+3" or
          chem "Pt+2" or chem "PT+2" or
          chem "Pt+4" or chem "PT+4" or
          chem "Pb+2" or chem "PB+2" or
          chem "Pb+4" or chem "PB+4" or
          chem "Pu+3" or chem "PU+3" or
          chem "Pu+4" or chem "PU+4" or
          chem "Pu+6" or chem "PU+6" ))
  6.434500 1.906700 4.179100 27.157000 1.780000 0.526000 1.490800 68.164497 1.204900
  FDP 0.095000
SCATter ( chemical S* and not (
          chem "Sc" or chem "SC" or chem "Sc+3" or chem "SC+3" or
          chem "Se" or chem "SE" or
          chem "Sr" or chem "SR" or chem "Sr+2" or chem "SR+2" or
          chem "Sn" or chem "SN" or chem "Sn+2" or chem "SN+2" or chem "Sn+4" or chem "SN+4" or
          chem "Sb" or chem "SB" or chem "Sb+3" or chem "SB+3" or chem "Sb+5" or chem "SB+5" or
          chem "Smm" or chem "SMM" or chem "Sm+3" or chem "SM+3" or
          chem "Si" or chem "SI" or chem "Si+4" or chem "SI+4"  ))
  6.905300 1.467900 5.203400 22.215099 1.437900 0.253600 1.586300 56.172001 0.976900
  FDP 0.124000
SCATter ( chemical "Cl" or chemical "CL" )
  11.460400 0.010400 7.196400 1.166200 6.255600 18.519400 1.645500 47.778400 -9.425400
  FDP 0.159000
SCATter ( chemical "Cl-1" or chemical "CL-1" )
  18.291500 0.006600 7.208400 1.171700 6.533700 19.542400 2.338600 60.448601 -16.246000
  FDP 0.159000
SCATter ( chemical "Ar" or chemical "AR" )
  7.484500 0.907200 6.772300 14.840700 0.653900 43.898300 1.644200 33.392899 1.599500
  FDP 0.201000
SCATter ( chemical "K" )
  8.218599 12.794900 7.439800 0.774800 1.051900 213.186996 0.865900 41.684097 1.601800
  FDP 0.250000
SCATter ( chemical "K+1" or chemical "K+1" )
  7.957800 12.633100 7.491700 0.767400 6.359000 -0.002000 1.191500 31.912800 -4.818800
  FDP 0.250000
SCATter ( chemical "Ca" or chemical "CA" )
  8.626600 10.442100 7.387300 0.659900 1.589900 85.748398 1.021100 178.436996 1.578100
  FDP 0.306000
SCATter ( chemical "Ca+2" or chemical "CA+2" )
  15.634800 -0.007400 7.951800 0.608900 8.437200 10.311600 0.853700 25.990499 -14.672000
  FDP 0.306000
SCATter ( chemical "Sc" or chemical "SC" )
  9.189000 9.021299 7.367900 0.572900 1.640900 136.108002 1.468000 51.353100 1.558900
  FDP 0.372000
SCATter ( chemical "Sc+3" or chemical "SC+3" )
  14.400800 0.298540 8.027300 7.962900 1.659430 -0.286040 1.579360 16.066200 -6.440700
  FDP 0.372000
SCATter ( chemical "Ti" or chemical "TI" )
  9.759500 7.850800 7.355800 0.500000 1.699100 35.633801 1.902100 116.104996 1.528700
  FDP 0.446000
SCATter ( chemical "Ti+2" or chemical "TI+2" )
  9.114230 7.524300 7.621740 0.457585 2.279300 19.536100 0.087899 61.655800 1.145155
  FDP 0.446000
SCATter ( chemical "Ti+3" or chemical "TI+3" )
  17.734400 0.220610 8.738160 7.047160 5.256910 -0.157620 1.921340 15.976800 -14.404000
  FDP 0.446000
SCATter ( chemical "Ti+4" or chemical "TI+4" )
  19.511400 0.178847 8.234730 6.670180 2.013410 -0.292630 1.520800 12.946400 -13.032000
  FDP 0.446000
SCATter ( chemical "V" )
  10.297100 6.865700 7.351100 0.438500 2.070300 26.893799 2.057100 102.477997 1.486900
  FDP 0.530000
SCATter ( chemical "V+2" or chemical "V+2" )
  10.106000 6.881800 7.354100 0.440900 2.288400 20.300400 0.022300 115.122002 1.496800
  FDP 0.530000
SCATter ( chemical "V+3" or chemical "V+3" )
  9.431410 6.395350 7.741900 0.383349 2.153430 15.190800 0.016865 63.969002 0.923565
  FDP 0.530000
SCATter ( chemical "V+5" or chemical "V+5" )
  15.688700 0.679003 8.142080 5.401350 2.030810 9.972780 -9.576000 0.940464 1.981300
  FDP 0.530000
SCATter ( chemical "Cr" or chemical "CR" )
  10.640600 6.103800 7.353700 0.392000 3.324000 20.262600 1.492200 98.739899 1.467200
  FDP 0.624000
SCATter ( chemical "Cr+2" or chemical "CR+2" )
  9.540340 5.660780 7.750900 0.344261 3.582740 13.307500 0.509107 32.422401 0.900898
  FDP 0.624000
SCATter ( chemical "Cr+3" or chemical "CR+3" )
  9.680900 5.594630 7.811360 0.334393 2.876030 12.828800 0.113575 32.876099 0.802275
  FDP 0.624000
SCATter ( chemical "Mn" or chemical "MN" )
  11.281900 5.340900 7.357300 0.343200 3.019300 17.867399 2.244100 83.754303 1.384600
  FDP 0.729000
SCATter ( chemical "Mn+2" or chemical "MN+2" )
  10.806100 5.279600 7.362000 0.343500 3.526800 14.343000 0.218400 41.323502 1.382400
  FDP 0.729000
SCATter ( chemical "Mn+3" or chemical "MN+3" )
  9.845210 4.917970 7.871940 0.294393 3.565310 10.817100 0.323613 24.128099 0.688974
  FDP 0.729000
SCATter ( chemical "Mn+4" or chemical "MN+4" )
  9.962530 4.848500 7.970570 0.283303 2.760670 10.485200 0.054447 27.573000 0.546877
  FDP 0.729000
SCATter ( chemical "Fe" or chemical "FE" )
  11.769500 4.761100 7.357300 0.307200 3.522200 15.353500 2.304500 76.880501 1.337900
  FDP 0.845000
SCATter ( chemical "Fe+2" or chemical "FE+2" )
  11.042400 4.653800 7.374000 0.305300 4.134600 12.054600 0.439900 31.280899 1.310700
  FDP 0.845000
SCATter ( chemical "Fe+3" or chemical "FE+3" )
  11.176400 4.614700 7.386300 0.300500 3.394800 11.672900 0.072400 38.556599 1.271700
  FDP 0.845000
SCATter ( chemical "Co" or chemical "CO" )
  12.284100 4.279100 7.340900 0.278400 4.003400 13.535900 2.348800 71.169197 1.310800
  FDP 0.973000
SCATter ( chemical "Co+2" or chemical "CO+2" )
  11.229600 4.123100 7.388300 0.272600 4.739300 10.244300 0.710800 25.646599 1.231400
  FDP 0.973000
SCATter ( chemical "Co+3" or chemical "CO+3" )
  10.337999 3.909690 7.881730 0.238668 4.767950 8.355830 0.725591 18.349100 0.585667
  FDP 0.973000
SCATter ( chemical "Ni" or chemical "NI" )
  12.837600 3.878500 7.292000 0.256500 4.443800 12.176300 2.380000 66.342102 1.319100
  FDP 1.113000
SCATter ( chemical "Ni+2" or chemical "NI+2" )
  11.416600 3.676600 7.400500 0.244900 5.344200 8.873000 0.977300 22.162600 1.146400
  FDP 1.113000
SCATter ( chemical "Ni+3" or chemical "NI+3" )
  10.780600 3.547700 7.758680 0.223140 5.227460 7.644680 0.847114 16.967300 0.671044
  FDP 1.113000
SCATter ( chemical "Cu" or chemical "CU" )
  13.337999 3.582800 7.167600 0.247000 5.615800 11.396600 1.673500 64.812599 1.454000
  FDP 1.266000
SCATter ( chemical "Cu+1" or chemical "CU+1" )
  11.947500 3.366900 7.357300 0.227400 6.245500 8.662500 1.557800 25.848700 1.153000
  FDP 1.266000
SCATter ( chemical "Cu+2" or chemical "CU+2" )
  11.816800 3.374840 7.111810 0.244078 5.781350 7.987600 1.145230 19.896999 1.407310
  FDP 1.266000
SCATter ( chemical "Zn" or chemical "ZN" )
  14.074300 3.265500 7.031800 0.233300 5.162500 10.316299 2.410000 58.709702 1.526100
  FDP 1.431000
SCATter ( chemical "Zn+2" or chemical "ZN+2" )
  11.971900 2.994600 7.386200 0.203100 6.466800 7.082600 1.394000 18.099499 1.002700
  FDP 1.431000
SCATter ( chemical "Ga" or chemical "GA" )
  15.235400 3.066900 6.700600 0.241200 4.359100 10.780500 2.962300 61.413498 1.881900
  FDP 1.609000
SCATter ( chemical "Ga+3" or chemical "GA+3" )
  12.691999 2.812620 6.698830 0.227890 6.066920 6.364410 1.006600 14.412200 1.698450
  FDP 1.609000
SCATter ( chemical "Ge" or chemical "GE" )
  16.081600 2.850900 6.374700 0.251600 3.706800 11.446800 3.683000 54.762501 2.212300
  FDP 1.801000
SCATter ( chemical "Ge+4" or chemical "GE+4" )
  12.917200 2.537180 6.700030 0.205855 6.067910 5.479130 0.859041 11.603000 1.536720
  FDP 1.801000
SCATter ( chemical "As" or chemical "AS" )
  16.672300 2.634500 6.070100 0.264700 3.431300 12.947900 4.277900 47.797199 2.501000
  FDP 2.007000
SCATter ( chemical "Se" or chemical "SE" )
  17.000599 2.409800 5.819600 0.272600 3.973100 15.237200 4.354300 43.816299 2.662900
  FDP 2.223000
SCATter ( chemical "Br" or chemical "BR" )
  17.178900 2.172300 5.235800 16.579599 5.637700 0.260900 3.985100 41.432800 2.581700
  FDP 2.456000
SCATter ( chemical "Br-1" or chemical "BR-1" )
  17.171799 2.205900 6.333800 19.334499 5.575400 0.287100 3.727200 58.153500 2.803600
  FDP 2.456000
SCATter ( chemical "Kr" or chemical "KR" )
  17.355499 1.938400 6.728600 16.562300 5.549300 0.226100 3.537500 39.397202 2.173000
  FDP 2.713000
SCATter ( chemical "Rb" or chemical "RB" )
  17.178400 1.788800 9.643499 17.315100 5.139900 0.274800 1.529200 164.933990 2.443300
  FDP 2.973000
SCATter ( chemical "Rb+1" or chemical "RB+1" )
  17.581600 1.713900 7.659800 14.795700 5.898100 0.160300 2.781700 31.208700 1.034200
  FDP 2.973000
SCATter ( chemical "Sr" or chemical "SR" )
  17.566299 1.556400 9.818399 14.098800 5.422000 0.166400 2.669400 132.376007 0.849400
  FDP 3.264000
SCATter ( chemical "Sr+2" or chemical "SR+2" )
  18.087400 1.490700 8.137300 12.696300 2.565400 24.565100 -34.193001 -0.013800 39.745500
  FDP 3.264000
SCATter ( chemical "Y" )
  17.775999 1.402900 10.294600 12.800600 5.726290 0.125599 3.265880 104.353996 -1.038870
  FDP 3.542000
SCATter ( chemical "Y+3" or chemical "Y+3" )
  17.926800 1.354170 9.153100 11.214500 1.767950 22.659901 -33.108002 -0.013190 37.309201
  FDP 3.542000
SCATter ( chemical "Zr" or chemical "ZR" )
  17.876499 1.276180 10.948000 11.916000 5.417320 0.117622 3.657210 87.662697 -0.895710
  FDP 0.560000
SCATter ( chemical "Zr+4" or chemical "ZR+4" )
  18.166800 1.214800 10.056200 10.148300 1.011180 21.605400 -2.647900 -0.102760 6.449539
  FDP 0.560000
SCATter ( chemical "Nb" or chemical "NB" )
  17.614201 1.188650 12.014400 11.766000 4.041830 0.204785 3.533460 69.795700 1.558910
  FDP 0.621000
SCATter ( chemical "Nb+3" or chemical "NB+3" )
  19.881199 0.019175 18.065300 1.133050 11.017700 10.162100 1.947150 28.338900 -15.109000
  FDP 0.621000
SCATter ( chemical "Nb+5" or chemical "NB+5" )
  17.916300 1.124460 13.341700 0.028781 10.799000 9.282060 0.337905 25.722799 -8.590400
  FDP 0.621000
SCATter ( chemical "Mo" or chemical "MO" )
  3.702500 0.277200 17.235600 1.095800 12.887600 11.004000 3.742900 61.658401 2.562500
  FDP 0.688000
SCATter ( chemical "Mo+3" or chemical "MO+3" )
  21.166401 0.014734 18.201700 1.030310 11.742300 9.536590 2.309510 26.630699 -16.246000
  FDP 0.688000
SCATter ( chemical "Mo+5" or chemical "MO+5" )
  21.014900 0.014345 18.099199 1.022380 11.463200 8.788090 0.740625 23.345200 -16.141000
  FDP 0.688000
SCATter ( chemical "Mo+6" or chemical "MO+6" )
  17.887100 1.036490 11.175000 8.480610 6.578910 0.058881 0.000000 0.000000 -1.480059
  FDP 0.688000
SCATter ( chemical "Tc" or chemical "TC" )
  19.130100 0.864132 11.094800 8.144870 4.649010 21.570700 2.712630 86.847198 4.814280
  FDP 0.759000
SCATter ( chemical "Ru" or chemical "RU" )
  19.267399 0.808520 12.918200 8.434669 4.863370 24.799700 1.567560 94.292801 3.958740
  FDP 0.836000
SCATter ( chemical "Ru+3" or chemical "RU+3" )
  18.563801 0.847329 13.288500 8.371640 9.326019 0.017662 3.009640 22.886999 -4.609200
  FDP 0.836000
SCATter ( chemical "Ru+4" or chemical "RU+4" )
  18.500299 0.844582 13.178699 8.125340 4.713040 0.364950 2.185350 20.850399 0.003570
  FDP 0.836000
SCATter ( chemical "Rh" or chemical "RH" )
  19.295700 0.751536 14.350100 8.217580 4.734250 25.874901 1.289180 98.606201 4.041000
  FDP 0.919000
SCATter ( chemical "Rh+3" or chemical "RH+3" )
  18.878500 0.764252 14.125900 7.844380 3.325150 21.248699 -6.198900 -0.010360 10.580800
  FDP 0.919000
SCATter ( chemical "Rh+4" or chemical "RH+4" )
  18.854500 0.760825 13.980600 7.624360 2.534640 19.331699 -5.652600 -0.010200 9.996500
  FDP 0.919000
SCATter ( chemical "Pd" or chemical "PD" )
  19.331900 0.698655 15.501699 7.989290 5.295370 25.205200 0.605844 76.898598 4.088930
  FDP 1.007000
SCATter ( chemical "Pd+2" or chemical "PD+2" )
  19.170099 0.696219 15.209600 7.555730 4.322340 22.505699 0.000000 0.000000 4.114600
  FDP 1.007000
SCATter ( chemical "Pd+4" or chemical "PD+4" )
  19.249300 0.683839 14.790000 7.148330 2.892890 17.914400 -7.949200 0.005127 11.840400
  FDP 1.007000
SCATter ( chemical "Ag" or chemical "AG" )
  19.280800 0.644600 16.688499 7.472600 4.804500 24.660500 1.046300 99.815598 4.094000
  FDP 1.101000
SCATter ( chemical "Ag+1" or chemical "AG+1" )
  19.181200 0.646179 15.971900 7.191230 5.274750 21.732599 0.357534 66.114700 4.130720
  FDP 1.101000
SCATter ( chemical "Ag+2" or chemical "AG+2" )
  19.164299 0.645643 16.245600 7.185440 4.370900 21.407200 0.000000 0.000000 4.129040
  FDP 1.101000
SCATter ( chemical "Cd" or chemical "CD" )
  19.221399 0.594600 17.644400 6.908900 4.461000 24.700800 1.602900 87.482498 4.064400
  FDP 1.202000
SCATter ( chemical "Cd+2" or chemical "CD+2" )
  19.151400 0.597922 17.253500 6.806390 4.471280 20.252100 0.000000 0.000000 4.114370
  FDP 1.202000
SCATter ( chemical "In" or chemical "IN" )
  19.162399 0.547600 18.559601 6.377600 4.294800 25.849899 2.039600 92.802902 4.003100
  FDP 1.310000
SCATter ( chemical "In+3" or chemical "IN+3" )
  19.104500 0.551522 18.110800 6.324700 3.788970 17.359501 0.000000 0.000000 4.060350
  FDP 1.310000
SCATter ( chemical "Sn" or chemical "SN" )
  19.188900 5.830300 19.100500 0.503100 4.458500 26.890900 2.466300 83.957100 3.909100
  FDP 1.424000
SCATter ( chemical "Sn+2" or chemical "SN+2" )
  19.109400 0.503600 19.054800 5.837800 4.564800 23.375200 0.487000 62.206100 3.913100
  FDP 1.424000
SCATter ( chemical "Sn+4" or chemical "SN+4" )
  18.933300 5.764000 19.713100 0.465500 3.418200 14.004900 0.019300 -0.758300 3.045200
  FDP 1.424000
SCATter ( chemical "Sb" or chemical "SB" )
  19.641800 5.303400 19.045500 0.460700 5.037100 27.907400 2.682700 75.282501 3.774900
  FDP 1.546000
SCATter ( chemical "Sb+3" or chemical "SB+3" )
  18.975500 0.467196 18.932999 5.221260 5.107890 19.590200 0.288753 55.511299 3.880260
  FDP 1.546000
SCATter ( chemical "Sb+5" or chemical "SB+5" )
  19.868500 5.448530 19.030199 0.467973 2.412530 14.125900 0.000000 0.000000 3.876630
  FDP 1.546000
SCATter ( chemical "Te" or chemical "TE" )
  19.964399 4.817420 19.013800 0.420885 6.144870 28.528400 2.523900 70.840302 3.580000
  FDP 1.675000
SCATter ( chemical "I" )
  20.147200 4.347000 18.994900 0.381400 7.513800 27.765999 2.273500 66.877602 3.345200
  FDP 1.812000
SCATter ( chemical "I-1" or chemical "I-1" )
  20.233200 4.357900 18.997000 0.381500 7.806900 29.525900 2.886800 84.930397 3.345400
  FDP 1.812000
SCATter ( chemical "Xe" or chemical "XE" )
  20.293301 3.928200 19.029800 0.344000 8.976700 26.465900 1.990000 64.265800 3.027800
  FDP 1.958000
SCATter ( chemical "Cs" or chemical "CS" )
  20.389200 3.569000 19.106199 0.310700 10.662000 24.387899 1.495300 213.903992 2.691200
  FDP 2.119000
SCATter ( chemical "Cs+1" or chemical "CS+1" )
  20.352400 3.552000 19.127800 0.308600 10.282100 23.712799 0.961500 59.456497 2.635100
  FDP 2.119000
SCATter ( chemical "Ba" or chemical "BA" )
  20.336100 3.216000 19.297001 0.275600 10.888000 20.207300 2.695900 167.201996 2.160100
  FDP 2.282000
SCATter ( chemical "Ba+2" or chemical "BA+2" )
  20.180700 3.213670 19.113600 0.283310 10.905399 20.055799 0.776340 51.745998 2.416020
  FDP 2.282000
SCATter ( chemical "La" or chemical "LA" )
  20.577999 2.948170 19.598999 0.244475 11.372700 18.772600 3.287190 133.123993 1.558780
  FDP 2.452000
SCATter ( chemical "La+3" or chemical "LA+3" )
  20.248899 2.920700 19.376301 0.250698 11.632299 17.821100 0.336048 54.945297 1.820600
  FDP 2.452000
SCATter ( chemical "Ce" or chemical "CE" )
  21.167099 2.812190 19.769501 0.226836 11.851299 17.608299 3.330490 127.112999 1.298640
  FDP 2.632000
SCATter ( chemical "Ce+3" or chemical "CE+3" )
  20.803600 2.776910 19.559000 0.231540 11.936900 16.540800 0.612376 43.169201 1.526130
  FDP 2.632000
SCATter ( chemical "Ce+4" or chemical "CE+4" )
  20.323500 2.659410 19.818600 0.218850 12.123300 15.799200 0.144583 62.235500 1.027800
  FDP 2.632000
SCATter ( chemical "Pr" or chemical "PR" )
  22.043999 2.773930 19.669701 0.222087 12.385600 16.766899 2.824280 143.643997 1.528300
  FDP 2.845000
SCATter ( chemical "Pr+3" or chemical "PR+3" )
  21.372700 2.645200 19.749100 0.214299 12.132900 15.323000 0.975180 36.406502 1.241320
  FDP 2.845000
SCATter ( chemical "Pr+4" or chemical "PR+4" )
  20.941299 2.544670 20.053900 0.202481 12.466800 14.813700 0.296689 45.464298 0.712850
  FDP 2.845000
SCATter ( chemical "Nd" or chemical "ND" )
  22.684500 2.662480 19.684700 0.210628 12.774000 15.885000 2.851370 137.903000 1.449860
  FDP 3.018000
SCATter ( chemical "Nd+3" or chemical "ND+3" )
  21.961000 2.527220 19.933899 0.199237 12.120000 14.178300 1.510310 30.871700 0.940880
  FDP 3.018000
SCATter ( chemical "Pm" or chemical "PM" )
  23.340500 2.562700 19.609501 0.202088 13.123500 15.100900 2.875160 132.720993 1.498760
  FDP 3.225000
SCATter ( chemical "Pm+3" or chemical "PM+3" )
  22.552700 2.417400 20.110800 0.185769 12.067100 13.127500 2.074920 27.449100 0.664990
  FDP 3.225000
SCATter ( chemical "Smm" or chemical "SMM" )
  24.004200 2.472740 19.425800 0.196451 13.439600 14.399600 2.896040 128.007004 1.676630
  FDP 3.442000
SCATter ( chemical "Sm+3" or chemical "SM+3" )
  23.150400 2.316410 20.259899 0.174081 11.920200 12.157100 2.714880 24.824200 0.421586
  FDP 3.442000
SCATter ( chemical "Eu" or chemical "EU" )
  24.627399 2.387900 19.088600 0.194200 13.760300 13.754600 2.922700 123.173996 2.032500
  FDP 3.669000
SCATter ( chemical "Eu+2" or chemical "EU+2" )
  24.006300 2.277830 19.950399 0.173530 11.803400 11.609600 3.872430 26.515600 0.821890
  FDP 3.669000
SCATter ( chemical "Eu+3" or chemical "EU+3" )
  23.749699 2.222580 20.374500 0.163940 11.850900 11.311000 3.265030 22.996599 0.217344
  FDP 3.669000
SCATter ( chemical "Gd" or chemical "GD" )
  25.070900 2.253410 19.079800 0.181951 13.851800 12.933100 3.545450 101.397995 1.855600
  FDP 3.904000
SCATter ( chemical "Gd+3" or chemical "GD+3" )
  24.346600 2.135530 20.420799 0.155525 11.870800 10.578199 3.714900 21.702900 0.081089
  FDP 3.904000
SCATter ( chemical "Tb" or chemical "TB" )
  25.897600 2.242560 18.218500 0.196143 14.316700 12.664800 2.953540 115.362000 2.991240
  FDP 4.151000
SCATter ( chemical "Tb+3" or chemical "TB+3" )
  24.955900 2.056010 20.327099 0.149525 12.247100 10.049900 3.773000 21.277300 0.100967
  FDP 4.151000
SCATter ( chemical "Dy" or chemical "DY" )
  26.507000 2.180200 17.638300 0.202172 14.559600 12.189899 2.965770 111.874001 3.678280
  FDP 4.410000
SCATter ( chemical "Dy+3" or chemical "DY+3" )
  25.539499 1.980400 20.286100 0.143384 11.981200 9.349720 4.500730 19.580999 0.070690
  FDP 4.410000
SCATter ( chemical "Ho" or chemical "HO" )
  26.904900 2.070510 17.293999 0.197940 14.558300 11.440700 3.638370 92.656601 3.901960
  FDP 4.678000
SCATter ( chemical "Ho+3" or chemical "HO+3" )
  26.129601 1.910720 20.099400 0.139358 11.978800 8.800180 4.936760 18.590799 0.186795
  FDP 4.678000
SCATter ( chemical "Er" or chemical "ER" )
  27.656300 2.073560 16.428499 0.223545 14.977900 11.360400 2.982330 105.703003 5.197460
  FDP 4.958000
SCATter ( chemical "Er+3" or chemical "ER+3" )
  26.722000 1.846590 19.774799 0.137290 12.150600 8.362249 5.173790 17.897400 0.453130
  FDP 4.958000
SCATter ( chemical "Tm" or chemical "TM" )
  28.181900 2.028590 15.885099 0.238849 15.154200 10.997499 2.987060 102.960999 5.961210
  FDP 5.248000
SCATter ( chemical "Tm+3" or chemical "TM+3" )
  27.308300 1.787110 19.332001 0.136974 12.333900 7.967780 5.383480 17.292200 0.844290
  FDP 5.248000
SCATter ( chemical "Yb" or chemical "YB" )
  28.664101 1.988900 15.434500 0.257119 15.308700 10.664700 2.989630 100.417000 6.682720
  FDP 5.548000
SCATter ( chemical "Yb+2" or chemical "YB+2" )
  28.120899 1.785030 17.681700 0.159970 13.333500 8.183040 5.146570 20.389999 2.825830
  FDP 5.548000
SCATter ( chemical "Yb+3" or chemical "YB+3" )
  27.891701 1.732720 18.761400 0.138790 12.607200 7.644120 5.476470 16.814301 1.376010
  FDP 5.548000
SCATter ( chemical "Lu" or chemical "LU" )
  28.947599 1.901820 15.220800 9.985189 15.100000 0.261033 3.716010 84.329803 6.988280
  FDP 5.858000
SCATter ( chemical "Lu+3" or chemical "LU+3" )
  28.462799 1.682160 18.121000 0.142292 12.842899 7.337270 5.594150 16.353500 1.987730
  FDP 5.858000
SCATter ( chemical "Hf" or chemical "HF" )
  29.143999 1.832620 15.172600 9.599899 14.758600 0.275116 4.300130 72.028999 7.463540
  FDP 6.185000
SCATter ( chemical "Hf+4" or chemical "HF+4" )
  28.813099 1.591360 18.460100 0.128903 12.728500 6.762320 5.599270 14.036600 1.278990
  FDP 6.185000
SCATter ( chemical "Ta" or chemical "TA" )
  29.202400 1.773330 15.229300 9.370460 14.513500 0.295977 4.764920 63.364399 7.985540
  FDP 6.523000
SCATter ( chemical "Ta+5" or chemical "TA+5" )
  29.158699 1.507110 18.840700 0.116741 12.826799 6.315240 5.386950 12.424400 0.527550
  FDP 6.523000
SCATter ( chemical "W" )
  29.081800 1.720290 15.430000 9.225900 14.432700 0.321703 5.119820 57.056000 8.466500
  FDP 6.872000
SCATter ( chemical "W+6" or chemical "W+6" )
  29.493599 1.427550 19.376301 0.104621 13.054399 5.936670 5.064120 11.197200 -0.410260
  FDP 6.872000
SCATter ( chemical "Re" or chemical "RE" )
  28.762100 1.671910 15.718900 9.092270 14.556400 0.350500 5.441740 52.086098 8.874000
  FDP 7.232000
SCATter ( chemical "Os" or chemical "OS" )
  28.189400 1.629030 16.154999 8.979480 14.930500 0.382661 5.675890 48.164700 9.184500
  FDP 7.605000
SCATter ( chemical "Os+4" or chemical "OS+4" )
  30.418999 1.371130 15.263700 6.847060 14.745800 0.165191 5.067950 18.003000 4.682040
  FDP 7.605000
SCATter ( chemical "Ir" or chemical "IR" )
  27.304899 1.592790 16.729599 8.865530 15.611500 0.417916 5.833770 45.001099 9.406200
  FDP 7.990000
SCATter ( chemical "Ir+3" or chemical "IR+3" )
  30.415600 1.343230 15.862000 7.109090 13.614500 0.204633 5.820080 20.325399 6.213030
  FDP 7.990000
SCATter ( chemical "Ir+4" or chemical "IR+4" )
  30.705799 1.309230 15.551200 6.719830 14.232600 0.167252 5.536720 17.491100 4.902240
  FDP 7.990000
SCATter ( chemical "Pt" or chemical "PT" )
  27.005899 1.512930 17.763901 8.811740 15.713100 0.424593 5.783700 38.610298 9.336300
  FDP 8.388000
SCATter ( chemical "Pt+2" or chemical "PT+2" )
  29.842899 1.329270 16.722401 7.389790 13.215300 0.263297 6.352340 22.942600 7.501290
  FDP 8.388000
SCATter ( chemical "Pt+4" or chemical "PT+4" )
  30.961201 1.248130 15.982900 6.608340 13.734800 0.168640 5.920340 16.939199 5.043340
  FDP 8.388000
SCATter ( chemical "Au" or chemical "AU" )
  16.881901 0.461100 18.591299 8.621600 25.558201 1.482600 5.860000 36.395599 9.377800
  FDP 8.798000
SCATter ( chemical "Au+1" or chemical "AU+1" )
  28.010899 1.353210 17.820400 7.739500 14.335899 0.356752 6.580770 26.404301 8.541900
  FDP 8.798000
SCATter ( chemical "Au+3" or chemical "AU+3" )
  30.688599 1.219900 16.902901 6.828720 12.780100 0.212867 6.523540 18.659000 6.408800
  FDP 8.798000
SCATter ( chemical "Hg" or chemical "HG" )
  20.680901 0.545000 19.041700 8.448400 21.657499 1.572900 5.967600 38.324600 9.524900
  FDP 9.223000
SCATter ( chemical "Hg+1" or chemical "HG+1" )
  25.085300 1.395070 18.497299 7.651050 16.888300 0.443378 6.482160 28.226200 8.936500
  FDP 9.223000
SCATter ( chemical "Hg+2" or chemical "HG+2" )
  29.564100 1.211520 18.059999 7.056390 12.837400 0.284738 6.899120 20.748199 7.542800
  FDP 9.223000
SCATter ( chemical "Tl" or chemical "TL" )
  27.544600 0.655150 19.158400 8.707510 15.538000 1.963470 5.525930 45.814899 9.618600
  FDP 9.659000
SCATter ( chemical "Tl+1" or chemical "TL+1" )
  21.398500 1.471100 20.472300 0.517394 18.747799 7.434630 6.828470 28.848200 8.969800
  FDP 9.659000
SCATter ( chemical "Tl+3" or chemical "TL+3" )
  30.869499 1.100800 18.384100 6.538520 11.932800 0.219074 7.005740 17.211399 6.246700
  FDP 9.659000
SCATter ( chemical "Pb" or chemical "PB" )
  31.061699 0.690200 13.063700 2.357600 18.441999 8.618000 5.969600 47.257900 9.278800
  FDP 10.102000
SCATter ( chemical "Pb+2" or chemical "PB+2" )
  21.788601 1.336600 19.568199 0.488383 19.140600 6.772700 7.011070 23.813200 8.340400
  FDP 10.102000
SCATter ( chemical "Pb+4" or chemical "PB+4" )
  32.124397 1.005660 18.800301 6.109260 12.017500 0.147041 6.968860 14.714000 3.951280
  FDP 10.102000
SCATter ( chemical "Bi" or chemical "BI" )
  33.368900 0.704000 12.951000 2.923800 16.587700 8.793700 6.469200 48.009300 8.717199
  FDP 10.559000
SCATter ( chemical "Bi+3" or chemical "BI+3" )
  21.805300 1.235600 19.502600 6.241490 19.105301 0.469999 7.102950 20.318501 7.610100
  FDP 10.559000
SCATter ( chemical "Bi+5" or chemical "BI+5" )
  33.536400 0.916540 25.094601 0.390420 19.249699 5.714140 6.915550 12.828500 -11.660400
  FDP 10.559000
SCATter ( chemical "Po" or chemical "PO" )
  34.672600 0.700999 15.473300 3.550780 13.113800 9.556419 7.025880 47.004501 7.753000
  FDP 11.042000
SCATter ( chemical "At" or chemical "AT" )
  35.316299 0.685870 19.021099 3.974580 9.498870 11.382400 7.425180 45.471500 6.266800
  FDP 9.961000
SCATter ( chemical "Rn" or chemical "RN" )
  35.563099 0.663100 21.281601 4.069100 8.003700 14.042200 7.443300 44.247299 4.828500
  FDP 10.403000
SCATter ( chemical "Fr" or chemical "FR" )
  35.929901 0.646453 23.054699 4.176190 12.143900 23.105200 2.112530 150.644989 5.812700
  FDP 7.754000
SCATter ( chemical "Ra" or chemical "RA" )
  35.763000 0.616341 22.906399 3.871350 12.473900 19.988701 3.210970 142.324997 6.001099
  FDP 8.105000
SCATter ( chemical "Ra+2" or chemical "RA+2" )
  35.215000 0.604909 21.670000 3.576700 7.913420 12.601000 7.650780 29.843599 5.923100
  FDP 8.105000
SCATter ( chemical "Ac" or chemical "AC" )
  35.659698 0.589092 23.103199 3.651550 12.597700 18.598999 4.086550 117.019997 5.801600
  FDP 8.472000
SCATter ( chemical "Ac+3" or chemical "AC+3" )
  35.173599 0.579689 22.111200 3.414370 8.192160 12.918700 7.055450 25.944300 5.738699
  FDP 8.472000
SCATter ( chemical "Th" or chemical "TH" )
  35.564499 0.563359 23.421900 3.462040 12.747300 17.830900 4.807030 99.172195 5.304400
  FDP 8.870000
SCATter ( chemical "Th+4" or chemical "TH+4" )
  35.100700 0.555054 22.441799 3.244980 9.785540 13.466100 5.294440 23.953300 5.248999
  FDP 8.870000
SCATter ( chemical "Pa" or chemical "PA" )
  35.884701 0.547751 23.294800 3.415190 14.189100 16.923500 4.172870 105.250999 4.468699
  FDP 9.284000
SCATter ( chemical "U" )
  36.022800 0.529300 23.412800 3.325300 14.949100 16.092699 4.188000 100.612999 2.723600
  FDP 9.653999
SCATter ( chemical "U+3" or chemical "U+3" )
  35.574699 0.520480 22.525900 3.122930 12.216499 12.714800 5.370730 26.339399 2.636200
  FDP 9.653999
SCATter ( chemical "U+4" or chemical "U+4" )
  35.371498 0.516598 22.532600 3.050530 12.029100 12.572300 4.798400 23.458200 2.594099
  FDP 9.653999
SCATter ( chemical "U+6" or chemical "U+6" )
  34.850899 0.507079 22.758400 2.890300 14.009900 13.176700 1.214570 25.201700 2.493500
  FDP 9.653999
SCATter ( chemical "Np" or chemical "NP" )
  36.187401 0.511929 23.596399 3.253960 15.640200 15.362200 4.185500 97.490799 2.199300
  FDP 4.148000
SCATter ( chemical "Np+3" or chemical "NP+3" )
  35.707397 0.502322 22.612999 3.038070 12.989799 12.144899 5.432270 25.492800 2.096400
  FDP 4.148000
SCATter ( chemical "Np+4" or chemical "NP+4" )
  35.510300 0.498626 22.578699 2.966270 12.776600 11.948400 4.921590 22.750200 2.053599
  FDP 4.148000
SCATter ( chemical "Np+6" or chemical "NP+6" )
  35.013599 0.489810 22.728600 2.810990 14.388400 12.330000 1.756690 22.658100 1.955000
  FDP 4.148000
SCATter ( chemical "Pu" or chemical "PU" )
  36.525398 0.499384 23.808300 3.263710 16.770700 14.945499 3.479470 105.979996 3.656200
  FDP 4.330000
SCATter ( chemical "Pu+3" or chemical "PU+3" )
  35.840000 0.484936 22.716900 2.961180 13.580700 11.533100 5.660160 24.399200 3.474100
  FDP 4.330000
SCATter ( chemical "Pu+4" or chemical "PU+4" )
  35.649300 0.481422 22.646000 2.890200 13.359500 11.316000 5.188310 21.830099 3.430500
  FDP 4.330000
SCATter ( chemical "Pu+6" or chemical "PU+6" )
  35.173599 0.473204 22.718100 2.738480 14.763500 11.552999 2.286780 20.930300 3.333200
  FDP 4.330000
SCATter ( chemical "Am" or chemical "AM" )
  36.670601 0.483629 24.099199 3.206470 17.341499 14.313600 3.493310 102.272995 4.433200
  FDP 4.511000
SCATter ( chemical "Cm" or chemical "CM" )
  36.648800 0.465154 24.409599 3.089970 17.399000 13.434600 4.216650 88.483398 4.872700
  FDP 4.697000
SCATter ( chemical "Bk" or chemical "BK" )
  36.788101 0.451018 24.773600 3.046190 17.891899 12.894600 4.232840 86.002998 5.285400
  FDP 4.908000
SCATter ( chemical "Cff" or chemical "CFF" )
  36.918499 0.437533 25.199499 3.007750 18.331699 12.404400 4.243910 83.788101 5.584400
  FDP 5.107000

set echo=true end
set message=true end