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	hartrees
Energy at 0K	-2835.624995
Energy at 298.15K	-2835.622718
HF Energy	-2835.199297
Nuclear repulsion energy	183.110106

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1445	1393	866.75
2	Σ	519	500	1.68
3	Π	349	336	5.40
3	Π	349	336	5.40

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.590
S2	0.000	0.000	-2.161
Se3	0.000	0.000	1.121

	C1	S2	Se3
C1		1.5713	1.7113
S2	1.5713		3.2826
Se3	1.7113	3.2826

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

using model chemistry: CCSD/aug-cc-pVDZ

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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