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	hartrees
Energy at 0K	-527.997317
Energy at 298.15K	-527.997991
HF Energy	-527.997317
Nuclear repulsion energy	95.867490

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	1176	47.79	5.89	0.58	0.74
2	A'	975	975	19.38	22.58	0.22	0.36
3	A'	307	307	17.57	3.49	0.56	0.71

Atom	x (Å)	y (Å)
S1	0.000	0.312
N2	1.434	-0.177
O3	-1.255	-0.470

	S1	N2	O3
S1		1.5154	1.4788
N2	1.5154		2.7050
O3	1.4788	2.7050

Number	Element	Mulliken
1	S	0.351
2	N	-0.168
3	O	-0.183

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

using model chemistry: B97D3/6-31G(2df,p)

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
	-0.205	0.962	0.000	0.983
CHELPG
AIM
ESP

	x	y	z
x	5.632	-0.004	0.000
y	-0.004	2.940	0.000
z	0.000	0.000	2.548

<r²>	45.168
(<r²>)^1/2	6.721