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. 2012 Oct 24;68(Pt 11):m1396–m1397. doi: 10.1107/S1600536812043346
Refinement on F2 0 restraints
Least-squares matrix: full H-atom parameters constrained
R[F2 > 2σ(F2)] = 0.035 w = 1/[σ2(Fo2) + (0.0333P)2 + 0.8637P] where P = (Fo2 + 2Fc2)/3
wR(F2) = 0.085 (Δ/σ)max = 0.001
S = 1.05 Δρmax = 0.40 e Å3
11760 reflections Δρmin = −0.41 e Å3
640 parameters