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	hartrees
Energy at 0K	-2835.715672
Energy at 298.15K	-2835.713407
HF Energy	-2835.228147
Nuclear repulsion energy	185.432185

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1494	1397	855.84
2	Σ	538	503	1.94
3	Π	348	326	6.41
3	Π	348	326	6.41

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.584
S2	0.000	0.000	-2.134
Se3	0.000	0.000	1.107

	C1	S2	Se3
C1		1.5499	1.6912
S2	1.5499		3.2410
Se3	1.6912	3.2410

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

using model chemistry: MP3/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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