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	hartrees
Energy at 0K	-510.466370
Energy at 298.15K	-510.466103
HF Energy	-510.168682
Nuclear repulsion energy	76.326836

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	1933	1865	518.77	24.94	0.17	0.30
2	Σ	808	780	3.60	37.18	0.31	0.47
3	Π	459	444	0.25	3.07	0.75	0.86
3	Π	459	444	0.25	3.07	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.538
O2	0.000	0.000	-1.751
S3	0.000	0.000	1.077

	C1	O2	S3
C1		1.2140	1.6148
O2	1.2140		2.8288
S3	1.6148	2.8288

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

using model chemistry: MP2/SDD

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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