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	hartrees
Energy at 0K	-484.463776
Energy at 298.15K	-484.462593
Nuclear repulsion energy	25.994304

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.337
Cl2	0.000	0.000	0.393

	B1	Cl2
B1		1.7306
Cl2	1.7306

All results from a given calculation for BCl (boron monochloride)

using model chemistry: CCSD(T)/aug-cc-pVTZ

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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