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Unit cell parameters of the experimental (Exp) and predicted crystal structures (ID 630 and ID 315) of QA.
| Space Group | Volume/Å3 | a/Å | b/Å | c/Å | α/° | β/° | γ/° | |
|---|---|---|---|---|---|---|---|---|
| Exp | P21/c (14) | 658.495 | 7.4218 | 12.7050 | 7.8342 | 90.000 | 116.950 | 90.000 |
| ID 630 | P21/c (14) | 653.542 | 7.8209 | 12.5746 | 8.0365 | 90.000 | 124.218 | 90.000 |
| ID 315 | P212121 (19) | 663.373 | 14.0748 | 6.7988 | 6.9324 | 90.000 | 90.000 | 90.000 |
