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	hartrees
Energy at 0K	-2837.349769
Energy at 298.15K	-2837.347522
HF Energy	-2837.349769
Nuclear repulsion energy	185.125654

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1494	1432	686.08
2	Σ	532	510	0.42
3	Π	361	346	4.61
3	Π	361	346	4.61

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.585
S2	0.000	0.000	-2.137
Se3	0.000	0.000	1.109

	C1	S2	Se3
C1		1.5526	1.6939
S2	1.5526		3.2464
Se3	1.6939	3.2464

Number	Element	Mulliken
1	C	-0.193
2	S	0.124
3	Se	0.068

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

using model chemistry: PBE1PBE/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>	139.254
(<r²>)^1/2	11.801