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	hartrees
Energy at 0K	-2837.875668
Energy at 298.15K	-2837.873394
HF Energy	-2837.875668
Nuclear repulsion energy	184.232392

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1450	1401	649.10
2	Σ	516	498	0.48
3	Π	355	343	4.87
3	Π	355	343	4.87

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.589
S2	0.000	0.000	-2.147
Se3	0.000	0.000	1.114

	C1	S2	Se3
C1		1.5588	1.7030
S2	1.5588		3.2618
Se3	1.7030	3.2618

Number	Element	Mulliken
1	C	-0.183
2	S	0.122
3	Se	0.061

All results from a given calculation for SCSe (Carbon sulfide selenide)

using model chemistry: B3LYPultrafine/6-311G*

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>	140.492
(<r²>)^1/2	11.853