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	hartrees
Energy at 0K	-527.871657
Energy at 298.15K	-527.872088
HF Energy	-527.871657
Nuclear repulsion energy	85.313459

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'	863	817	3.10	24.20	0.38	0.55
2	A'	601	569	7.59	6.84	0.34	0.50
3	A'	268	254	16.06	9.55	0.75	0.85

Atom	x (Å)	y (Å)
S1	0.000	0.486
N2	1.473	-0.483
O3	-1.289	-0.550

	S1	N2	O3
S1		1.7628	1.6536
N2	1.7628		2.7619
O3	1.6536	2.7619

Number	Element	Mulliken
1	S	0.736
2	N	-0.268
3	O	-0.468

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

using model chemistry: mPW1PW91/6-31G

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
	0.802	1.728	0.000	1.905
CHELPG
AIM
ESP

	x	y	z
x	6.037	0.103	0.000
y	0.103	3.300	0.000
z	0.000	0.000	1.903

<r²>	51.742
(<r²>)^1/2	7.193