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. 2008 Sep 13;64(Pt 10):o1923. doi: 10.1107/S1600536808028596
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)] = 0.066 Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.207 H-atom parameters constrained
S = 1.13 w = 1/[σ2(Fo2) + (0.135P)2 + 0.237P] where P = (Fo2 + 2Fc2)/3
2576 reflections (Δ/σ)max = 0.045
309 parameters Δρmax = 0.80 e Å3
1 restraint Δρmin = −0.33 e Å3