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	hartrees
Energy at 0K	-527.839115
Energy at 298.15K	-527.839820
HF Energy	-527.839115
Nuclear repulsion energy	96.192189

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'	1209	1199	53.71	5.40	0.75	0.86
2	A'	1000	992	31.21	35.85	0.19	0.32
3	A'	326	323	15.36	2.98	0.55	0.71

Atom	x (Å)	y (Å)
S1	0.000	0.299
N2	1.437	-0.137
O3	-1.258	-0.477

	S1	N2	O3
S1		1.5021	1.4780
N2	1.5021		2.7166
O3	1.4780	2.7166

Number	Element	Mulliken
1	S	0.568
2	N	-0.290
3	O	-0.278

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

using model chemistry: PBEPBE/6-311+G(3df,2p)

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
	-0.253	0.966	0.000	0.998
CHELPG
AIM
ESP

	x	y	z
x	6.700	0.142	0.000
y	0.142	3.678	0.000
z	0.000	0.000	3.229

<r²>	45.660
(<r²>)^1/2	6.757