/usr/share/doc/avogadro/examples/cdspectrum is in avogadro 1.2.0-1+deb9u1.
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1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 | # Electronic CD-spectrum of TmoleXProject, IRREP a
# excitation energy / nm rotatory strength (length rep.) / 10^(-40)erg*cm^3
0.51771458833972E+04 0.24551680696311E+02
0.38217791169285E+04 -.59641571239319E+01
0.36352611539307E+04 -.28163674999368E+01
0.27601363420300E+04 0.23367854176676E+01
0.25749411835411E+04 -.36117011351285E-01
0.18742341501653E+04 0.93506721845688E-01
0.17288777464454E+04 -.49751937363249E+01
0.10004939028461E+04 0.68955547911471E-01
0.97982560979027E+03 0.18270121581766E+00
0.82601931456821E+03 -.15612470270879E+00
0.75466351334867E+03 -.84150733104407E+01
0.73522041777523E+03 0.32429244449821E+01
0.72928111958920E+03 0.19845680807045E+01
0.69168023154282E+03 -.15786388313583E+02
0.63785521958334E+03 -.12275945563630E+01
0.63388710812928E+03 -.28544029029107E-02
0.63017899670516E+03 -.12941557747152E+02
0.62211244765369E+03 -.52894697494757E-02
0.61573574562386E+03 -.41700461047601E-03
0.60851880441555E+03 -.44953785538491E-03
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