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. 2008 May 10;64(Pt 6):o1048. doi: 10.1107/S160053680801338X
Refinement on F2 Secondary atom site location: structure-invariant direct methods
Least-squares matrix: full Hydrogen site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.040 All H-atom parameters refined
wR(F2) = 0.107   w = 1/[σ2(Fo2) + (0.0608P)2 + 0.2293P] where P = (Fo2 + 2Fc2)/3
S = 1.04 (Δ/σ)max < 0.001
2276 reflections Δρmax = 0.17 e Å3
210 parameters Δρmin = −0.24 e Å3
Primary atom site location: heavy-atom method Extinction correction: none