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	hartrees
Energy at 0K	-858.197249
Energy at 298.15K	-858.196968
HF Energy	-858.021945
Nuclear repulsion energy	72.510589

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-1.023
Cl2	0.000	0.000	0.962

	S1	Cl2
S1		1.9850
Cl2	1.9850

All results from a given calculation for SCl (sulfur monochloride)

using model chemistry: B2PLYP=FULL/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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