data_global _chemical_name_mineral 'Moganite' loop_ _publ_author_name 'Heaney P J' 'Post J E' _journal_name_full 'American Mineralogist' _journal_volume 86 _journal_year 2001 _journal_page_first 1358 _journal_page_last 1366 _publ_section_title ; Evidence for an I2/a to Imab phase transition in the silica polymorph moganite at ~570 K Sample: T = 1354 K ; _database_code_amcsd 0002738 _chemical_formula_sum 'Si O2' _cell_length_a 8.8159 _cell_length_b 4.9371 _cell_length_c 10.7605 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 468.351 _exptl_crystal_density_diffrn 2.556 _symmetry_space_group_name_H-M 'I m a b' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2+y,1/2+z' '1/2+x,y,-z' '+x,1/2+y,1/2-z' '1/2-x,-y,z' '-x,1/2-y,1/2+z' 'x,-y,-z' '1/2+x,1/2-y,1/2-z' '-x,y,z' '1/2-x,1/2+y,1/2+z' '1/2-x,y,-z' '-x,1/2+y,1/2-z' '1/2+x,-y,z' '+x,1/2-y,1/2+z' '-x,-y,-z' '1/2-x,1/2-y,1/2-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Si1 0.25000 0.00000 0.00000 0.03000 Si2 0.00000 0.22550 0.17010 0.03000 O1 0.00000 0.04160 0.29350 0.03000 O2 0.14710 0.20070 0.08240 0.03000