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. 2008 Nov 13;64(Pt 12):o2361. doi: 10.1107/S1600536808036416
Refinement on F2 Hydrogen site location: inferred from neighbouring sites
Least-squares matrix: full H-atom parameters constrained
R[F2 > 2σ(F2)] = 0.041   w = 1/[σ2(F2) + (0.04P)2 + 0.59P], where P = [max(Fo2,0) + 2Fc2]/3
wR(F2) = 0.098 (Δ/σ)max = 0.0001
S = 0.93 Δρmax = 0.32 e Å3
1528 reflections Δρmin = −0.33 e Å3
172 parameters Extinction correction: None
Primary atom site location: structure-invariant direct methods