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	hartrees
Energy at 0K	-2835.717031
Energy at 298.15K	-2835.714754
HF Energy	-2835.228039
Nuclear repulsion energy	185.078479

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1476	1400	894.68
2	Σ	531	503	1.98
3	Π	346	328	5.85
3	Π	346	328	5.85

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.585
S2	0.000	0.000	-2.138
Se3	0.000	0.000	1.109

	C1	S2	Se3
C1		1.5531	1.6942
S2	1.5531		3.2473
Se3	1.6942	3.2473

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

using model chemistry: CCD/TZVP

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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