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	hartrees
Energy at 0K	-2835.174504
Energy at 298.15K	-2835.172473
HF Energy	-2835.174504
Nuclear repulsion energy	185.819060

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1531	1462	652.26
2	Σ	549	524	0.02
3	Π	470	449	4.87
3	Π	470	449	4.87

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.577
S2	0.000	0.000	-2.131
Se3	0.000	0.000	1.105

	C1	S2	Se3
C1		1.5541	1.6821
S2	1.5541		3.2362
Se3	1.6821	3.2362

Number	Element	Mulliken
1	C	0.026
2	S	-0.108
3	Se	0.082

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

using model chemistry: PBE1PBE/6-31+G**

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>	138.523
(<r²>)^1/2	11.770