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	hartrees
Energy at 0K	-528.066676
Energy at 298.15K	-528.067234
HF Energy	-528.066676
Nuclear repulsion energy	92.743580

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'	1027	1025	64.29	9.07	0.59	0.74
2	A'	901	900	16.06	30.81	0.13	0.23
3	A'	242	241	24.21	6.40	0.63	0.77

Atom	x (Å)	y (Å)
S1	0.000	0.349
N2	1.457	-0.216
O3	-1.275	-0.510

	S1	N2	O3
S1		1.5633	1.5377
N2	1.5633		2.7483
O3	1.5377	2.7483

Number	Element	Mulliken
1	S	0.984
2	N	-0.429
3	O	-0.555

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

using model chemistry: BLYP/aug-cc-pVDZ

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
	0.124	1.331	0.000	1.336
CHELPG
AIM
ESP

	x	y	z
x	7.086	0.191	0.000
y	0.191	3.896	0.000
z	0.000	0.000	3.284

<r²>	47.678
(<r²>)^1/2	6.905