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	hartrees
Energy at 0K	-452.716482
Energy at 298.15K
HF Energy	-452.602179
Nuclear repulsion energy	39.405627

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.458
N2	0.000	0.000	-1.046

	S1	N2
S1		1.5040
N2	1.5040

All results from a given calculation for NS (Mononitrogen monosulfide)

using model chemistry: B2PLYP=FULLultrafine/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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