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	hartrees
Energy at 0K	-510.883449
Energy at 298.15K	-510.883351
HF Energy	-510.340447
Nuclear repulsion energy	79.555811

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2204	2082	956.86
2	Σ	898	848	18.22
3	Π	546	516	4.35
3	Π	546	516	4.35

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.530
O2	0.000	0.000	-1.676
S3	0.000	0.000	1.037

	C1	O2	S3
C1		1.1464	1.5664
O2	1.1464		2.7128
S3	1.5664	2.7128

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

using model chemistry: MP3/cc-pVTZ

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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