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. 2009 Jul 18;65(Pt 8):o1898. doi: 10.1107/S1600536809027159
Refinement on F2 Primary atom site location: structure-invariant direct methods
Least-squares matrix: full Secondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.063 Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.164 H-atom parameters constrained
S = 1.00 w = 1/[σ2(Fo2) + (0.0896P)2 + 0.022P] where P = (Fo2 + 2Fc2)/3
4669 reflections (Δ/σ)max = 0.001
524 parameters Δρmax = 0.19 e Å3
14 restraints Δρmin = −0.20 e Å3