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	hartrees
Energy at 0K	-548.785941
Energy at 298.15K	-548.786668
HF Energy	-548.447439
Nuclear repulsion energy	87.153932

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	877	850	73.28
2	A'	822	797	42.32
3	A'	416	403	0.79

Atom	x (Å)	y (Å)
N1	0.000	0.804
S2	-0.826	-0.656
F3	1.468	0.540

	N1	S2	F3
N1		1.6773	1.4913
S2	1.6773		2.5863
F3	1.4913	2.5863

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

using model chemistry: QCISD/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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