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 O-Al

wB97X-D/3-21G

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

Values greater than 1.69 are in the 1.69 bin. Values less than 1.69 are in the 1.69 bin.

	5
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	1
	0
		1.69			1.69			1.69			1.69			1.69			1.69			1.69			1.69			1.69			1.69			1.69			1.69			1.69
bond lengths (Å)