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	hartrees
Energy at 0K	-528.169364
Energy at 298.15K	-528.170215
HF Energy	-528.169364
Nuclear repulsion energy	88.313378

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	1650	1599	501.37	21.32	0.49	0.66
2	A'	811	786	34.34	19.06	0.15	0.26
3	A'	510	494	2.01	1.49	0.71	0.83

Atom	x (Å)	y (Å)
N1	0.000	0.617
S2	-0.505	-0.888
O3	1.010	1.237

	N1	S2	O3
N1		1.5872	1.1848
S2	1.5872		2.6093
O3	1.1848	2.6093

Number	Element	Mulliken
1	N	-0.022
2	S	0.140
3	O	-0.118

All results from a given calculation for SNO (Nitrogen oxide sulfide)

using model chemistry: B3LYP/cc-pVQZ

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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	x	y	z	Total
	-0.373	-0.643	0.000	0.743
CHELPG
AIM
ESP

	x	y	z
x	4.577	2.032	0.000
y	2.032	6.647	0.000
z	0.000	0.000	3.005

<r²>	54.450
(<r²>)^1/2	7.379