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	hartrees
Energy at 0K	-527.946241
Energy at 298.15K	-527.947038
HF Energy	-527.946241
Nuclear repulsion energy	85.024481

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'	1623	1536	397.39	15.79	0.37	0.55
2	A'	716	678	26.90	15.29	0.24	0.39
3	A'	491	465	0.74	4.95	0.72	0.84

Atom	x (Å)	y (Å)
N1	0.000	0.666
S2	-0.520	-0.929
O3	1.040	1.274

	N1	S2	O3
N1		1.6777	1.2045
S2	1.6777		2.6992
O3	1.2045	2.6992

Number	Element	Mulliken
1	N	-0.058
2	S	0.263
3	O	-0.205

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

using model chemistry: mPW1PW91/6-31G

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
	-0.132	-0.511	0.000	0.527
CHELPG
AIM
ESP

	x	y	z
x	3.359	2.344	0.000
y	2.344	5.938	0.000
z	0.000	0.000	1.630

<r²>	57.816
(<r²>)^1/2	7.604