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	hartrees
Energy at 0K	-2833.319371
Energy at 298.15K	-2833.317158
HF Energy	-2832.936800
Nuclear repulsion energy	184.865496

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1500	1417	816.71
2	Σ	538	508	0.71
3	Π	380	359	2.63
3	Π	380	359	2.63

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.586
S2	0.000	0.000	-2.140
Se3	0.000	0.000	1.111

	C1	S2	Se3
C1		1.5545	1.6964
S2	1.5545		3.2509
Se3	1.6964	3.2509

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

using model chemistry: CCSD/6-31G*

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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