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	hartrees
Energy at 0K	-528.035341
Energy at 298.15K	-528.036027
HF Energy	-528.035341
Nuclear repulsion energy	96.139931

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'	1212	1159	110.92	9.54	0.61	0.76
2	A'	1026	981	13.74	29.43	0.19	0.32
3	A'	308	295	40.39	4.91	0.74	0.85

Atom	x (Å)	y (Å)
S1	0.000	0.347
N2	1.399	-0.249
O3	-1.224	-0.477

	S1	N2	O3
S1		1.5206	1.4755
N2	1.5206		2.6325
O3	1.4755	2.6325

Number	Element	Mulliken
1	S	0.743
2	N	-0.249
3	O	-0.494

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

using model chemistry: B1B95/6-31+G**

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
	0.174	1.546	0.000	1.556
CHELPG
AIM
ESP

	x	y	z
x	6.237	0.003	0.000
y	0.003	3.095	0.000
z	0.000	0.000	2.540

<r²>	45.147
(<r²>)^1/2	6.719