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	hartrees
Energy at 0K	-2839.092207
Energy at 298.15K	-2839.089915
HF Energy	-2839.092207
Nuclear repulsion energy	184.210556

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1441	1421	477.07
2	Σ	506	499	0.38
3	Π	349	344	5.22
3	Π	349	344	5.22

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.591
S2	0.000	0.000	-2.147
Se3	0.000	0.000	1.115

	C1	S2	Se3
C1		1.5561	1.7054
S2	1.5561		3.2615
Se3	1.7054	3.2615

Number	Element	Mulliken
1	C	0.028
2	S	-0.066
3	Se	0.038

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

using model chemistry: B97D3/Def2TZVPP

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>	140.064
(<r²>)^1/2	11.835