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. 2013 Apr 20;69(Pt 5):m275–m276. doi: 10.1107/S1600536813009938
Refinement on F2 Secondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.050 Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.122 H-atom parameters constrained
S = 1.03 w = 1/[σ2(Fo2) + (0.0718P)2] where P = (Fo2 + 2Fc2)/3
12284 reflections (Δ/σ)max = 0.001
577 parameters Δρmax = 2.35 e Å3
0 restraints Δρmin = −1.54 e Å3
Primary atom site location: structure-invariant direct methods