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: 20 ; _database_code_amcsd 0007885 _chemical_formula_sum 'Si O2' _cell_length_a 5.4515 _cell_length_b 5.3227 _cell_length_c 5.8091 _cell_angle_alpha 77.9812 _cell_angle_beta 82.2353 _cell_angle_gamma 54.5766 _cell_volume 134.326 _exptl_crystal_density_diffrn 2.971 _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 0.63119 0.15529 0.92211 Si2 0.74028 0.53694 0.09612 Si3 0.07709 0.98438 0.51099 Si4 0.67431 0.80691 0.61642 O1 0.62734 0.88862 0.11558 O2 0.93048 0.81599 0.44260 O3 0.95278 0.06157 0.78337 O4 0.44530 0.75325 0.51403 O5 0.97640 0.28860 0.30715 O6 0.46678 0.14977 0.71234 O7 0.87702 0.52473 0.83219 O8 0.49365 0.46743 0.04826