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	hartrees
Energy at 0K	-510.405057
Energy at 298.15K	-510.404761
HF Energy	-510.155383
Nuclear repulsion energy	77.066917

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2054	1921	807.10
2	Σ	783	732	21.79
3	Π	446	417	8.83
3	Π	446	417	8.83

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.556
O2	0.000	0.000	-1.728
S3	0.000	0.000	1.072

	C1	O2	S3
C1		1.1719	1.6281
O2	1.1719		2.8000
S3	1.6281	2.8000

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

using model chemistry: CID/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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