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	hartrees
Energy at 0K	-452.311027
Energy at 298.15K	-452.310793
HF Energy	-451.950453
Nuclear repulsion energy	39.580914

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.456
N2	0.000	0.000	-1.042

	S1	N2
S1		1.4974
N2	1.4974

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

using model chemistry: CCD/aug-cc-pV(T+d)Z

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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