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: 17 ; _database_code_amcsd 0007882 _chemical_formula_sum 'Si O2' _cell_length_a 5.5569 _cell_length_b 5.2463 _cell_length_c 5.9716 _cell_angle_alpha 88.5667 _cell_angle_beta 114.2259 _cell_angle_gamma 94.0951 _cell_volume 158.353 _exptl_crystal_density_diffrn 2.520 _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 0.13331 0.18553 0.66792 Si2 0.67711 0.07354 0.19415 Si3 0.29764 0.69248 0.98863 Si4 0.18671 0.26282 0.20830 O1 0.17799 0.96268 0.87359 O2 0.61266 0.76700 0.14156 O3 0.22608 0.47365 0.78015 O4 0.87320 0.17109 0.06243 O5 0.82147 0.15236 0.48423 O6 0.38202 0.18349 0.08008 O7 0.19661 0.57335 0.19208 O8 0.28772 0.15463 0.49050