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	hartrees
Energy at 0K	-2837.258647
Energy at 298.15K	-2837.256339
HF Energy	-2837.258647
Nuclear repulsion energy	183.390144

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1442	1427	493.66
2	Σ	507	501	0.19
3	Π	343	339	5.66
3	Π	343	339	5.66

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.590
S2	0.000	0.000	-2.158
Se3	0.000	0.000	1.120

	C1	S2	Se3
C1		1.5681	1.7093
S2	1.5681		3.2774
Se3	1.7093	3.2774

Number	Element	Mulliken
1	C	-0.195
2	S	0.123
3	Se	0.073

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

using model chemistry: PBEPBEultrafine/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>	141.479
(<r²>)^1/2	11.895