FormaldehydeVibG03

FormaldehydeVibG03 - Harmonic frequencies (cm*-1), IR...

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Harmonic frequencies (cm**-1), IR intensities (KM/Mole), Raman scattering activities (A**4/AMU), depolarization ratios for plane and unpolarized incident light, reduced masses (AMU), force constants (mDyne/A), and normal coordinates: 1 2 3 B1 B2 A1 Frequencies -- 1335.3953 1383.4047 1679.2619 Red. masses -- 1.3687 1.3440 1.1038 Frc consts -- 1.4380 1.5154 1.8340 IR Inten -- 0.3735 23.1245 8.6181 Raman Activ -- 0.7608 4.5167 12.8384 Depolar (P) -- 0.7500 0.7500 0.5909 Depolar (U) -- 0.8571 0.8571 0.7429 Atom AN X Y Z X Y Z X Y Z 1 6 0.17 0.00 0.00 0.00 0.15 0.00 0.00 0.00 0.00 2 8 -0.04 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 0.08 3 1 -0.70 0.00 0.00 0.00 -0.25 -0.65 0.00 -0.35 -0.61 4 1 -0.70 0.00 0.00 0.00 -0.25 0.65 0.00 0.35 -0.61 4 5 6 A1 A1 B2 Frequencies -- 2027.5415 3161.4181 3233.7383 Red. masses -- 7.2562 1.0490 1.1206 Frc consts -- 17.5752 6.1772 6.9041 IR Inten -- 150.0223 49.5917 135.4759 Raman Activ -- 8.1287 137.5987 58.1798 Depolar (P) -- 0.3281 0.1829 0.7500 Depolar (U) --
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FormaldehydeVibG03 - Harmonic frequencies (cm*-1), IR...

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