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	hartrees
Energy at 0K	-501.803292
Energy at 298.15K	-501.804119
HF Energy	-501.803292
Nuclear repulsion energy	80.358657

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2274	2274	100.70
2	Σ	875	875	11.90
3	Π	418	418	0.96
3	Π	418	418	0.96

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.762
N2	0.000	0.000	-0.568
S3	0.000	0.000	1.019

	N1	N2	S3
N1		1.1936	2.7814
N2	1.1936		1.5878
S3	2.7814	1.5878

Number	Element	Mulliken
1	N	-0.035
2	N	-0.139
3	S	0.174

All results from a given calculation for NNS (Nitrogen sulfide)

using model chemistry: M06-2X/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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<r²>	53.947
(<r²>)^1/2	7.345