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	hartrees
Energy at 0K	-510.710579
Energy at 298.15K	-510.710380
HF Energy	-510.256674
Nuclear repulsion energy	78.498008

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	2096	2016
2	Σ	871	838
3	Π	491	472
3	Π	491	472

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.528
O2	0.000	0.000	-1.701
S3	0.000	0.000	1.049

	C1	O2	S3
C1		1.1735	1.5765
O2	1.1735		2.7499
S3	1.5765	2.7499

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

using model chemistry: CCSD(T)/6-31G*

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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