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. 2012 Oct 27;68(Pt 11):o3227–o3228. doi: 10.1107/S1600536812043899
Refinement on F2 11 restraints
Least-squares matrix: full H atoms treated by a mixture of independent and constrained refinement
R[F2 > 2σ(F2)] = 0.032 w = 1/[σ2(Fo2) + (0.0483P)2] where P = (Fo2 + 2Fc2)/3
wR(F2) = 0.084 (Δ/σ)max < 0.001
S = 1.02 Δρmax = 0.43 e Å3
3445 reflections Δρmin = −0.30 e Å3
172 parameters