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	hartrees
Energy at 0K	-2821.941837
Energy at 298.15K	-2821.939462
HF Energy	-2821.677814
Nuclear repulsion energy	177.364939

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	1359	1330
2	Σ	436	427
3	Π	340	332
3	Π	340	332

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.598
S2	0.000	0.000	-2.235
Se3	0.000	0.000	1.157

	C1	S2	Se3
C1		1.6375	1.7553
S2	1.6375		3.3929
Se3	1.7553	3.3929

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

using model chemistry: MP4=FULL/3-21G

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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