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	hartrees
Energy at 0K	-528.071990
Energy at 298.15K	-528.072835
HF Energy	-528.071990
Nuclear repulsion energy	87.397174

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'	1668	1599	412.73	16.04	0.39	0.56
2	A'	802	768	30.96	15.58	0.22	0.36
3	A'	511	490	1.65	2.79	0.73	0.84

Atom	x (Å)	y (Å)
N1	0.000	0.631
S2	-0.519	-0.890
O3	1.039	1.227

	N1	S2	O3
N1		1.6067	1.1978
S2	1.6067		2.6284
O3	1.1978	2.6284

Number	Element	Mulliken
1	N	0.067
2	S	0.136
3	O	-0.203

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

using model chemistry: TPSSh/6-31G**

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
	-0.191	-0.426	0.000	0.467
CHELPG
AIM
ESP

	x	y	z
x	3.621	2.143	0.000
y	2.143	5.761	0.000
z	0.000	0.000	1.987

<r²>	54.943
(<r²>)^1/2	7.412