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. 2024 Jun 21;80(Pt 7):767–770. doi: 10.1107/S205698902400584X
Refinement on F2 0 restraints
Least-squares matrix: full Hydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.056 H-atom parameters constrained
wR(F2) = 0.175 w = 1/[σ2(Fo2) + (0.0899P)2 + 0.3573P] where P = (Fo2 + 2Fc2)/3
S = 1.08 (Δ/σ)max < 0.001
2492 reflections Δρmax = 0.30 e Å3
164 parameters Δρmin = −0.27 e Å3