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Refinement on F2Secondary atom site location: difference Fourier map
Least-squares matrix: fullHydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.041H-atom parameters constrained
wR(F2) = 0.107  w = 1/[σ2(Fo2) + (0.0476P)2 + 0.3616P] where P = (Fo2 + 2Fc2)/3
S = 1.06(Δ/σ)max < 0.001
2537 reflectionsΔρmax = 0.20 e Å3
164 parametersΔρmin = −0.23 e Å3
Primary atom site location: structure-invariant direct methodsExtinction correction: none