% 1d
% alpha-MnO2 Mn 2p  OD1  (A230626011)- thin-particles- cal  (+0.36 eV) 
%  122
% from stack thin-particles
      631.178     0.00352430
      631.996     0.00347583
      632.814     0.00338094
      633.632     0.00352768
      634.450     0.00350540
      635.268     0.00351108
      636.086     0.00357658
      636.904     0.00371518
      637.722     0.00386289
      638.060     0.00398807
      638.240     0.00424025
      638.420     0.00465270
      638.540     0.00518373
      638.600     0.00550972
      638.780     0.00604858
      638.960     0.00686952
      639.140     0.00813631
      639.320      0.0100813
      639.358      0.0113370
      639.500      0.0134027
      639.860      0.0185506
      640.040      0.0206284
      640.220      0.0231457
      640.400      0.0252430
      640.580      0.0254288
      640.760      0.0228563
      640.940      0.0215851
      641.120      0.0220934
      641.300      0.0231285
      641.480      0.0237669
      641.660      0.0246676
      641.840      0.0262751
      642.020      0.0273137
      642.200      0.0282077
      642.380      0.0298537
      642.560      0.0302950
      642.740      0.0308610
      642.920      0.0313072
      643.100      0.0309720
      643.280      0.0306263
      643.460      0.0297937
      643.640      0.0287568
      643.820      0.0275269
      644.000      0.0263316
      644.180      0.0252027
      644.360      0.0239147
      644.540      0.0222861
      644.720      0.0207110
      644.900      0.0192967
      645.080      0.0178938
      645.260      0.0170632
      645.440      0.0158418
      645.620      0.0148917
      645.800      0.0145191
      645.980      0.0139690
      646.160      0.0132928
      646.360      0.0124753
      646.920      0.0112000
      647.480     0.00982586
      648.040     0.00917405
      648.600     0.00851865
      649.160     0.00865846
      649.660     0.00908526
      649.880     0.00967114
      650.100     0.00989196
      650.320      0.0110344
      650.540      0.0122885
      650.760      0.0134972
      650.980      0.0146763
      651.200      0.0162521
      651.420      0.0177049
      651.640      0.0190570
      651.860      0.0198914
      652.080      0.0205502
      652.300      0.0218762
      652.520      0.0225885
      652.740      0.0233035
      652.960      0.0234576
      653.180      0.0241491
      653.400      0.0238311
      653.620      0.0232230
      653.840      0.0229006
      654.060      0.0223537
      654.280      0.0213399
      654.500      0.0208447
      654.720      0.0197308
      654.940      0.0183656
      655.160      0.0169679
      655.380      0.0158032
      655.600      0.0143283
      655.820      0.0133912
      656.040      0.0127302
      656.260      0.0116358
      656.480      0.0111763
      656.700      0.0110533
      656.920      0.0102294
      657.140     0.00975769
      657.860     0.00889973
      658.822     0.00819999
      659.784     0.00774171
      660.746     0.00745571
      661.708     0.00748388
      662.670     0.00751196
      663.632     0.00755926
      665.556     0.00753298
      666.518     0.00759750
      669.404     0.00754206
      670.366     0.00755366
      671.360     0.00746859
      675.226     0.00741038
      677.159     0.00751854
      679.092     0.00778034
      681.025     0.00774430
      682.958     0.00775368
      684.891     0.00765841
      686.824     0.00755334
      688.757     0.00752834
      690.690     0.00776082
      692.623     0.00773697
      694.556     0.00760929
      696.489     0.00732249
      698.422     0.00672087
