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	hartrees
Energy at 0K	-2514.432231
Energy at 298.15K
HF Energy	-2514.432231
Nuclear repulsion energy	134.623481

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	2024	2007	621.51	31.88	0.75	0.86
2	Σ	656	651	3.47	22.20	0.08	0.14
3	Π	458	454	0.07	0.20	0.75	0.86
3	Π	458	454	0.07	0.20	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.021
O2	0.000	0.000	-2.187
Se3	0.000	0.000	0.695

	C1	O2	Se3
C1		1.1663	1.7161
O2	1.1663		2.8823
Se3	1.7161	2.8823

Number	Element	Mulliken
1	C	0.365
2	O	-0.455
3	Se	0.090

All results from a given calculation for OCSe (Carbonyl selenide)

using model chemistry: PBEPBE/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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<r²>	79.147
(<r²>)^1/2	8.896