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Computational Chemistry Comparison and Benchmark DataBase Release 21 (August 2020) Standard Reference Database 101 National Institute of Standards and Technology |
You are here: Calculated > Geometry > Calculated geometry > One type of bond |
H | Li | Be | B | C | N | O | F | Ne | Na | Mg | Al | Si | P | S | Cl | K | Ca | Ga | As | Se | Br | I | |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
H | 30 | 6 | 11 | 110 | 396 | 32 | 29 | 4 | 2 | 3 | 5 | 36 | 70 | 5 | 3 | 9 | 2 | 4 | 13 | 14 | 12 | 3 | 4 |
Li | 6 | 4 | 1 | 2 | 3 | 5 | 10 | 3 | 1 | 3 | 1 | 1 | 2 | 3 | 1 | 3 | 1 | ||||||
Be | 11 | 1 | 4 | 5 | 9 | 5 | 1 | 1 | 3 | 5 | 2 | ||||||||||||
B | 110 | 2 | 29 | 7 | 7 | 19 | 41 | 1 | 2 | 3 | 4 | 16 | 1 | 4 | |||||||||
C | 396 | 3 | 7 | 2404 | 279 | 458 | 271 | 4 | 2 | 9 | 88 | 201 | 3 | 1 | 3 | 5 | 61 | 6 | |||||
N | 32 | 5 | 5 | 7 | 279 | 64 | 112 | 34 | 2 | 4 | 4 | 9 | 14 | 10 | 3 | 2 | 1 | 1 | 2 | 3 | |||
O | 29 | 10 | 9 | 19 | 458 | 112 | 49 | 11 | 9 | 1 | 6 | 6 | 3 | 2 | 13 | 3 | 4 | 1 | 3 | 19 | 5 | ||
F | 4 | 3 | 5 | 41 | 271 | 34 | 11 | 5 | 3 | 5 | 9 | 29 | 33 | 58 | 6 | 1 | 3 | 5 | 14 | 4 | 11 | 1 | |
Ne | 2 | 1 | 2 | ||||||||||||||||||||
Na | 3 | 3 | 1 | 9 | 3 | 3 | 1 | 1 | 4 | 5 | 2 | 3 | 1 | ||||||||||
Mg | 5 | 1 | 1 | 2 | 1 | 5 | 1 | 3 | 3 | 5 | |||||||||||||
Al | 36 | 1 | 1 | 4 | 4 | 6 | 9 | 1 | 6 | 3 | 3 | 17 | 2 | 1 | |||||||||
Si | 70 | 2 | 2 | 4 | 6 | 29 | 6 | 4 | 3 | 24 | 2 | 6 | |||||||||||
P | 5 | 2 | 3 | 9 | 9 | 3 | 33 | 3 | 4 | 11 | 4 | 16 | 2 | 1 | 1 | 3 | |||||||
S | 3 | 3 | 4 | 88 | 14 | 2 | 58 | 4 | 3 | 3 | 3 | 4 | 41 | 14 | 1 | 1 | 3 | 1 | |||||
Cl | 9 | 3 | 5 | 16 | 201 | 10 | 13 | 6 | 5 | 5 | 17 | 24 | 16 | 14 | 6 | 1 | 3 | 5 | 4 | 3 | 3 | 1 | |
K | 2 | 1 | 3 | 3 | 3 | 1 | 2 | 1 | 1 | 1 | |||||||||||||
Ca | 4 | 1 | 4 | 3 | 1 | 3 | 1 | 3 | |||||||||||||||
Ga | 13 | 1 | 2 | 1 | 5 | 2 | 2 | 5 | 2 | 2 | |||||||||||||
As | 14 | 3 | 1 | 3 | 14 | 1 | 1 | 4 | 2 | 7 | 1 | ||||||||||||
Se | 12 | 5 | 1 | 19 | 4 | 2 | 1 | 3 | 3 | 1 | 4 | ||||||||||||
Br | 3 | 3 | 2 | 4 | 61 | 2 | 5 | 11 | 3 | 1 | 6 | 3 | 1 | 3 | 1 | 3 | 3 | 1 | |||||
I | 4 | 1 | 6 | 3 | 1 | 1 | 1 | 1 | 2 |