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	hartrees
Energy at 0K	-511.138540
Energy at 298.15K	-511.138383
HF Energy	-510.332484
Nuclear repulsion energy	78.770145

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	2013	2013
2	Σ	858	858
3	Π	514	514
3	Π	514	514

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.524
O2	0.000	0.000	-1.696
S3	0.000	0.000	1.045

	C1	O2	S3
C1		1.1721	1.5685
O2	1.1721		2.7406
S3	1.5685	2.7406

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

using model chemistry: MP4=FULL/6-311+G(3df,2p)

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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