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	hartrees
Energy at 0K	-521.521959
Energy at 298.15K
HF Energy	-521.493163
Nuclear repulsion energy	84.875989

Atom	x (Å)	y (Å)
S1	0.000	0.551
N2	1.392	-0.565
O3	-1.218	-0.607

	S1	N2	O3
S1		1.7842	1.6805
N2	1.7842		2.6106
O3	1.6805	2.6106

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

using model chemistry: B2PLYP=FULL/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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