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	hartrees
Energy at 0K	-528.073023
Energy at 298.15K	-528.073870
HF Energy	-528.073023
Nuclear repulsion energy	87.613346

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'	1658	1599	521.11	22.75	0.56	0.72
2	A'	806	777	37.09	18.39	0.16	0.28
3	A'	510	491	1.61	2.98	0.75	0.86

Atom	x (Å)	y (Å)
N1	0.000	0.626
S2	-0.516	-0.889
O3	1.033	1.230

	N1	S2	O3
N1		1.6002	1.1965
S2	1.6002		2.6246
O3	1.1965	2.6246

Number	Element	Mulliken
1	N	-0.190
2	S	0.155
3	O	0.035

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

using model chemistry: B3LYP/6-31+G**

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
	-0.379	-0.724	0.000	0.817
CHELPG
AIM
ESP

	x	y	z
x	4.400	2.191	0.000
y	2.191	6.771	0.000
z	0.000	0.000	2.536

<r²>	55.175
(<r²>)^1/2	7.428