Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Compare Calculated Bonds for C-S

MP3=FULL/cc-pCVDZ

Histogram of Bond lengths (in Å) vs number of species

Values greater than 1.84 are in the 1.84 bin. Values less than 1.83 are in the 1.83 bin.

	5
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	1
	0
		1.83			1.83			1.83			1.83			1.83			1.83			1.83			1.83			1.83			1.83			1.84
bond lengths (Å)