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	hartrees
Energy at 0K	-528.073259
Energy at 298.15K	-528.074121
HF Energy	-528.073259
Nuclear repulsion energy	88.785536

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'	1749	1675	481.83	18.24	0.44	0.61
2	A'	849	814	32.82	16.24	0.16	0.28
3	A'	510	488	2.83	1.44	0.72	0.84

Atom	x (Å)	y (Å)
N1	0.000	0.610
S2	-0.498	-0.887
O3	0.996	1.240

	N1	S2	O3
N1		1.5771	1.1786
S2	1.5771		2.5990
O3	1.1786	2.5990

Number	Element	Mulliken
1	N	0.276
2	S	-0.068
3	O	-0.208

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

using model chemistry: B1B95/6-31G(2df,p)

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
	-0.249	-0.414	0.000	0.483
CHELPG
AIM
ESP

	x	y	z
x	3.953	1.906	0.000
y	1.906	5.991	0.000
z	0.000	0.000	2.570

<r²>	53.753
(<r²>)^1/2	7.332