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. 2018 Aug 31;74(Pt 9):1369–1372. doi: 10.1107/S205698901801201X
Refinement on F2 0 restraints
Least-squares matrix: full Hydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.062 H-atom parameters constrained
wR(F2) = 0.144 w = 1/[σ2(Fo2) + (0.0526P)2 + 0.3159P] where P = (Fo2 + 2Fc2)/3
S = 1.05 (Δ/σ)max = 0.001
4960 reflections Δρmax = 0.43 e Å3
259 parameters Δρmin = −0.32 e Å3