data_global _amcsd_formula_title 'SiO2' loop_ _publ_author_name 'Boisen M B' 'Gibbs G V' 'Bukowinski M S T' _journal_name_full 'Physics and Chemistry of Minerals' _journal_volume 21 _journal_year 1994 _journal_page_first 269 _journal_page_last 284 _publ_section_title ; Framework silica structures generated using simulated annealing with a potential energy function based on an H6Si2O7 molecule Sample: 14 ; _database_code_amcsd 0007879 _chemical_formula_sum 'Si O2' _cell_length_a 5.8657 _cell_length_b 5.1519 _cell_length_c 5.3377 _cell_angle_alpha 92.6936 _cell_angle_beta 90.7338 _cell_angle_gamma 90.0688 _cell_volume 161.111 _exptl_crystal_density_diffrn 2.477 _symmetry_space_group_name_H-M 'P 1' loop_ _space_group_symop_operation_xyz 'x,y,z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Si1 0.09993 0.21417 0.23644 Si2 0.84312 0.85110 0.49421 Si3 0.10030 0.47770 0.74039 Si4 0.53953 0.35064 0.49265 O1 0.00245 0.33899 0.98339 O2 0.68637 0.59987 0.40748 O3 0.99205 0.35273 0.48362 O4 0.37609 0.24120 0.26115 O5 0.37645 0.45195 0.72274 O6 0.00933 0.77384 0.72822 O7 0.00859 0.91962 0.26120 O8 0.69721 0.10951 0.57922