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. 2019 Jul 26;75(Pt 8):1270–1273. doi: 10.1107/S2056989019010429
Refinement on F2 Secondary atom site location: difference Fourier map
Least-squares matrix: full Hydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.081 H-atom parameters constrained
wR(F2) = 0.249 w = 1/[σ2(Fo2) + (0.1501P)2] where P = (Fo2 + 2Fc2)/3
S = 1.01 (Δ/σ)max < 0.001
4261 reflections Δρmax = 0.55 e Å3
226 parameters Δρmin = −0.30 e Å3
1 restraint Absolute structure: Flack (1983)
Primary atom site location: structure-invariant direct methods Absolute structure parameter: 0.47 (19)