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	hartrees
Energy at 0K	-527.906086
Energy at 298.15K	-527.906452
HF Energy	-527.906086
Nuclear repulsion energy	85.165014

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'	813	807	15.87	13.19	0.40	0.57
2	A'	627	622	3.25	15.41	0.23	0.37
3	A'	220	218	20.27	9.52	0.75	0.86

Atom	x (Å)	y (Å)
S1	0.000	0.430
N2	1.539	-0.337
O3	-1.347	-0.565

	S1	N2	O3
S1		1.7193	1.6743
N2	1.7193		2.8946
O3	1.6743	2.8946

Number	Element	Mulliken
1	S	0.728
2	N	-0.286
3	O	-0.442

All results from a given calculation for NSO (sulfinyl amidogen)

using model chemistry: BLYP/6-31G

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
	0.574	1.599	0.000	1.699
CHELPG
AIM
ESP

	x	y	z
x	6.489	0.101	0.000
y	0.101	2.878	0.000
z	0.000	0.000	1.827

<r²>	52.906
(<r²>)^1/2	7.274