| Refinement on F2 | Primary atom site location: dual |
| Least-squares matrix: full | Hydrogen site location: mixed |
| R[F2 > 2σ(F2)] = 0.035 | H atoms treated by a mixture of independent and constrained refinement |
| wR(F2) = 0.083 | w = 1/[σ2(Fo2) + (0.0426P)2 + 1.0094P] where P = (Fo2 + 2Fc2)/3 |
| S = 1.02 | (Δ/σ)max = 0.001 |
| 7124 reflections | Δρmax = 0.65 e Å−3 |
| 394 parameters | Δρmin = −0.36 e Å−3 |
| 2 restraints |