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	hartrees
Energy at 0K	-528.083962
Energy at 298.15K	-528.084830
HF Energy	-528.083962
Nuclear repulsion energy	88.808529

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'	1714	1640	588.00	30.91	0.65	0.79
2	A'	844	808	45.15	21.85	0.10	0.18
3	A'	515	493	2.73	0.87	0.62	0.77

Atom	x (Å)	y (Å)
N1	0.000	0.614
S2	-0.501	-0.884
O3	1.001	1.231

	N1	S2	O3
N1		1.5800	1.1763
S2	1.5800		2.5948
O3	1.1763	2.5948

Number	Element	Mulliken
1	N	0.096
2	S	0.263
3	O	-0.359

All results from a given calculation for SNO (Nitrogen oxide sulfide)

using model chemistry: wB97X-D/aug-cc-pVTZ

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
	-0.305	-0.498	0.000	0.584
CHELPG
AIM
ESP

	x	y	z
x	5.232	1.891	0.000
y	1.891	7.113	0.000
z	0.000	0.000	3.624

<r²>	53.963
(<r²>)^1/2	7.346