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	hartrees
Energy at 0K	-2835.836030
Energy at 298.15K	-2835.833822
HF Energy	-2835.247526
Nuclear repulsion energy	185.634444

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1497	1497	906.05
2	Σ	537	537	1.72
3	Π	377	377	4.80
3	Π	377	377	4.80

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.586
S2	0.000	0.000	-2.131
Se3	0.000	0.000	1.106

	C1	S2	Se3
C1		1.5447	1.6919
S2	1.5447		3.2366
Se3	1.6919	3.2366

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

using model chemistry: CCD/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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