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	hartrees
Energy at 0K	-510.884301
Energy at 298.15K	-510.884176
HF Energy	-510.337991
Nuclear repulsion energy	79.141737

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	2100	1998	606.67	27.15	0.42	0.59
2	Σ	896	852	6.57	29.58	0.21	0.35
3	Π	530	504	1.28	0.73	0.75	0.86
3	Π	530	504	1.28	0.73	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.521
O2	0.000	0.000	-1.688
S3	0.000	0.000	1.040

	C1	O2	S3
C1		1.1674	1.5605
O2	1.1674		2.7279
S3	1.5605	2.7279

All results from a given calculation for OCS (Carbonyl sulfide)

using model chemistry: MP2/Def2TZVPP

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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