解像度: 2.3→34.28 Å / Rfactor Rfree error: 0.006 / Data cutoff high absF: 80028.33 / Data cutoff low absF: 0 / Isotropic thermal model: RESTRAINED / 交差検証法: THROUGHOUT / σ(F): 0 / 立体化学のターゲット値: Engh & Huber 詳細: The structure was refined using modified CNS files for tetartohedral twinning (Barends, et al., 2005, Acta Cryst D61, 613-621). The crystal structure has been determined from a ...詳細: The structure was refined using modified CNS files for tetartohedral twinning (Barends, et al., 2005, Acta Cryst D61, 613-621). The crystal structure has been determined from a tetartohedrally twinned crystal. The twinning operator are (h,k,l)(k,h,-l)(-k,-h,-l)(-h,-k,l) and the twinning fraction are 0.25, 0.25, 0.25, 0.25.