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	hartrees
Energy at 0K	-510.764421
Energy at 298.15K	-510.764257
HF Energy	-510.288345
Nuclear repulsion energy	78.190782

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	2083	1997
2	Σ	865	829
3	Π	508	487
3	Π	508	487

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.535
O2	0.000	0.000	-1.707
S3	0.000	0.000	1.054

	C1	O2	S3
C1		1.1713	1.5893
O2	1.1713		2.7606
S3	1.5893	2.7606

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

using model chemistry: QCISD(T)=FULL/cc-pVDZ

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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