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	hartrees
Energy at 0K	-527.835815
Energy at 298.15K	-527.836690
HF Energy	-527.667031
Nuclear repulsion energy	87.353741

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'	1852	1773	199.48	5.48	0.19	0.32
2	A'	821	786	109.76	51.16	0.38	0.55
3	A'	535	512	1.57	2.08	0.58	0.74

Atom	x (Å)	y (Å)
N1	0.000	0.631
S2	-0.508	-0.900
O3	1.017	1.248

	N1	S2	O3
N1		1.6136	1.1893
S2	1.6136		2.6349
O3	1.1893	2.6349

Number	Element	Mulliken
1	N	0.066
2	S	0.046
3	O	-0.112

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

using model chemistry: B2PLYP/cc-pVDZ

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
	-0.201	-0.393	0.000	0.441
CHELPG
AIM
ESP

	x	y	z
x	3.250	2.055	0.000
y	2.055	5.545	-0.000
z	0.000	-0.000	1.824

<r²>	55.165
(<r²>)^1/2	7.427