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	hartrees
Energy at 0K	-7019.971326
Energy at 298.15K
HF Energy	-7019.971326
Nuclear repulsion energy	240.867939

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	1350	1302	514.79	7.06	0.31	0.48
2	Σ	413	398	0.04	17.75	0.37	0.54
3	Π	322	311	7.26	0.04	0.75	0.86
3	Π	322	311	7.26	0.04	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.024
S2	0.000	0.000	-2.619
Te3	0.000	0.000	0.924

	C1	S2	Te3
C1		1.5958	1.9475
S2	1.5958		3.5433
Te3	1.9475	3.5433

Number	Element	Mulliken
1	C	-0.750
2	S	0.344
3	Te	0.406

All results from a given calculation for SCTe (Carbon sulfide Telluride)

using model chemistry: B3LYPultrafine/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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<r²>	189.298
(<r²>)^1/2	13.759