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	hartrees
Energy at 0K	-527.742284
Energy at 298.15K	-527.742991
HF Energy	-527.742284
Nuclear repulsion energy	95.930543

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'	1226	1168	86.68	7.77	0.54	0.70
2	A'	1019	971	9.08	21.70	0.23	0.38
3	A'	327	311	38.53	3.93	0.69	0.82

Atom	x (Å)	y (Å)
S1	0.000	0.349
N2	1.401	-0.258
O3	-1.226	-0.472

	S1	N2	O3
S1		1.5274	1.4761
N2	1.5274		2.6364
O3	1.4761	2.6364

Number	Element	Mulliken
1	S	0.761
2	N	-0.296
3	O	-0.465

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

using model chemistry: PBE1PBE/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
	0.070	1.417	0.000	1.418
CHELPG
AIM
ESP

	x	y	z
x	5.306	-0.062	0.000
y	-0.062	2.593	0.000
z	0.000	0.000	2.117

<r²>	44.941
(<r²>)^1/2	6.704