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	hartrees
Energy at 0K	-2513.460646
Energy at 298.15K	-2513.456762
HF Energy	-2510.309633
Nuclear repulsion energy	136.314069

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	2326	2326	1190.16	44.34	0.44	0.61
2	Σ	684	684	22.70	6.10	0.14	0.25
3	Π	556	556	10.55	0.65	0.75	0.86
3	Π	556	556	10.55	0.65	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.028
O2	0.000	0.000	-2.150
Se3	0.000	0.000	0.687

	C1	O2	Se3
C1		1.1223	1.7149
O2	1.1223		2.8372
Se3	1.7149	2.8372

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

using model chemistry: CBS-Q

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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