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	hartrees
Energy at 0K	-548.774491
Energy at 298.15K	-548.775274
HF Energy	-548.449975
Nuclear repulsion energy	88.021797

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	977	950	11.38
2	A'	853	829	38.06
3	A'	442	430	4.38

Atom	x (Å)	y (Å)
N1	0.000	0.800
S2	-0.818	-0.646
F3	1.454	0.526

	N1	S2	F3
N1		1.6615	1.4793
S2	1.6615		2.5559
F3	1.4793	2.5559

All results from a given calculation for FNS (Thionitrosyl fluoride)

using model chemistry: CCD/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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