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	hartrees
Energy at 0K	-528.067936
Energy at 298.15K	-528.068628
HF Energy	-528.067936
Nuclear repulsion energy	95.577127

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'	1181	1126	110.27	10.99	0.54	0.70
2	A'	997	951	6.82	28.66	0.20	0.34
3	A'	317	302	43.52	5.38	0.74	0.85

Atom	x (Å)	y (Å)
S1	0.000	0.366
N2	1.391	-0.287
O3	-1.217	-0.482

	S1	N2	O3
S1		1.5363	1.4833
N2	1.5363		2.6148
O3	1.4833	2.6148

Number	Element	Mulliken
1	S	0.547
2	N	-0.174
3	O	-0.374

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

using model chemistry: mPW1PW91/TZVP

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
	0.262	1.691	0.000	1.711
CHELPG
AIM
ESP

	x	y	z
x	5.889	-0.074	0.000
y	-0.074	2.931	0.000
z	0.000	0.000	2.099

<r²>	45.169
(<r²>)^1/2	6.721