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	hartrees
Energy at 0K	-521.770148
Energy at 298.15K	-521.770629
HF Energy	-521.770148
Nuclear repulsion energy	85.463101

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'	952	842	6.56	5.35	0.29	0.45
2	A'	748	662	8.03	4.07	0.41	0.59
3	A'	305	270	6.85	3.87	0.70	0.82

Atom	x (Å)	y (Å)
S1	0.000	0.522
N2	1.422	-0.549
O3	-1.244	-0.563

	S1	N2	O3
S1		1.7798	1.6502
N2	1.7798		2.6657
O3	1.6502	2.6657

Number	Element	Mulliken
1	S	0.344
2	N	-0.146
3	O	-0.198

All results from a given calculation for NSO (sulfinyl amidogen)

using model chemistry: B3PW91/STO-3G

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
	-0.047	1.087	0.000	1.088
CHELPG
AIM
ESP

	x	y	z
x	3.269	0.007	0.000
y	0.007	1.638	0.000
z	0.000	0.000	0.669

<r²>	48.632
(<r²>)^1/2	6.974