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	hartrees
Energy at 0K	-526.803624
Energy at 298.15K	-526.804538
HF Energy	-526.803624
Nuclear repulsion energy	99.604216

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1437	1437	227.86
2	A'	1240	1240	25.07
3	A'	501	501	59.26

Atom	x (Å)	y (Å)
S1	0.000	0.363
N2	1.325	-0.323
O3	-1.160	-0.443

	S1	N2	O3
S1		1.4920	1.4121
N2	1.4920		2.4878
O3	1.4121	2.4878

Number	Element	Mulliken
1	S	0.791
2	N	-0.281
3	O	-0.510

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

using model chemistry: ROHF/Def2TZVPP

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
	0.261	1.859	0.000	1.877
CHELPG
AIM
ESP

<r²>	42.590
(<r²>)^1/2	6.526