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. 2011 Jan 29;67(Pt 2):m285. doi: 10.1107/S1600536811002728
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)] = 0.028 Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.081 H-atom parameters constrained
S = 1.07 w = 1/[σ2(Fo2) + (0.0478P)2 + 0.0204P] where P = (Fo2 + 2Fc2)/3
2669 reflections (Δ/σ)max < 0.001
181 parameters Δρmax = 0.39 e Å−3
0 restraints Δρmin = −0.29 e Å−3