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. 2008 Jan 23;64(Pt 2):m374. doi: 10.1107/S160053680800161X
Refinement on F2 Secondary atom site location: difference Fourier map
Least-squares matrix: full Hydrogen site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.022 H-atom parameters constrained
wR(F2) = 0.048   w = 1/[σ2(Fo2) + (0.019P)2] where P = (Fo2 + 2Fc2)/3
S = 1.03 (Δ/σ)max = 0.001
8005 reflections Δρmax = 1.32 e Å3
523 parameters Δρmin = −0.82 e Å3
Primary atom site location: structure-invariant direct methods Extinction correction: none