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. 2014 Jun 23;70(Pt 7):14–17. doi: 10.1107/S1600536814009520
Refinement on F2 Primary atom site location: structure-invariant direct methods
Least-squares matrix: full Secondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.041 H-atom parameters not refined
wR(F2) = 0.087 w = 1/[σ2(Fo2) + (0.0319P)2 + 17.8096P] where P = (Fo2 + 2Fc2)/3
S = 1.07 (Δ/σ)max < 0.001
3196 reflections Δρmax = 2.88 e Å3
94 parameters Δρmin = −1.95 e Å3
0 restraints