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	hartrees
Energy at 0K	-528.008687
Energy at 298.15K	-528.009402
HF Energy	-528.008687
Nuclear repulsion energy	95.103052

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'	1176	1125	109.39	9.60	0.54	0.70
2	A'	1015	972	5.49	37.04	0.11	0.20
3	A'	333	319	34.74	3.74	0.72	0.84

Atom	x (Å)	y (Å)
S1	0.000	0.377
N2	1.388	-0.300
O3	-1.215	-0.490

	S1	N2	O3
S1		1.5447	1.4926
N2	1.5447		2.6102
O3	1.4926	2.6102

Number	Element	Mulliken
1	S	1.085
2	N	-0.462
3	O	-0.623

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

using model chemistry: wB97X-D/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
	0.286	1.654	0.000	1.679
CHELPG
AIM
ESP

	x	y	z
x	6.290	0.005	0.000
y	0.005	3.767	0.000
z	0.000	0.000	3.140

<r²>	45.339
(<r²>)^1/2	6.733