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	hartrees
Energy at 0K	-4841.807379
Energy at 298.15K	-4841.803245
HF Energy	-4841.807379
Nuclear repulsion energy	308.225806

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	390	373	0.00
2	Σ_u	1364	1307	586.52
3	Π_u	321	308	7.57
3	Π_u	321	308	7.57

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
Se2	0.000	0.000	1.693
Se3	0.000	0.000	-1.693

	C1	Se2	Se3
C1		1.6928	1.6928
Se2	1.6928		3.3856
Se3	1.6928	3.3856

Number	Element	Mulliken
1	C	-0.683
2	Se	0.341
3	Se	0.341

All results from a given calculation for CSe₂ (Carbon diselenide)

using model chemistry: B1B95/aug-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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<r²>	220.149
(<r²>)^1/2	14.837

All results from a given calculation for CSe2 (Carbon diselenide)

using model chemistry: B1B95/aug-cc-pVDZ

States and conformations

All results from a given calculation for CSe₂ (Carbon diselenide)