# generated using pymatgen data_Co2OF3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.70945000 _cell_length_b 5.66789918 _cell_length_c 13.32128766 _cell_angle_alpha 78.98913348 _cell_angle_beta 87.90697405 _cell_angle_gamma 87.81308263 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co2OF3 _chemical_formula_sum 'Co10 O5 F15' _cell_volume 348.62591790 _cell_formula_units_Z 5 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Co Co0 1 0.48438800 0.51155300 0.00587900 1.0 Co Co1 1 0.50747000 0.69631800 0.39736000 1.0 Co Co2 1 0.48784200 0.30085200 0.60424100 1.0 Co Co3 1 0.49928700 0.10037100 0.19935500 1.0 Co Co4 1 0.53984000 0.88831700 0.78638600 1.0 Co Co5 1 0.99939700 0.19910000 0.40059300 1.0 Co Co6 1 0.97563000 0.41353600 0.80624500 1.0 Co Co7 1 0.99671100 0.60229500 0.20125900 1.0 Co Co8 1 0.02023800 0.78706900 0.59521400 1.0 Co Co9 1 0.00139900 0.00308300 0.99862900 1.0 O O10 1 0.70305200 0.96729000 0.66261600 1.0 O O11 1 0.70173700 0.58077400 0.86218900 1.0 O O12 1 0.70000500 0.78197600 0.25834500 1.0 O O13 1 0.29513700 0.42431600 0.13951100 1.0 O O14 1 0.29844600 0.61982300 0.54063000 1.0 F F15 1 0.79966800 0.27913000 0.26064500 1.0 F F16 1 0.80278700 0.08605800 0.85851900 1.0 F F17 1 0.80074000 0.68837400 0.05980600 1.0 F F18 1 0.80251300 0.88010500 0.46174100 1.0 F F19 1 0.81001600 0.47206100 0.66308900 1.0 F F20 1 0.69040400 0.18577800 0.05833700 1.0 F F21 1 0.69392900 0.37910700 0.46297200 1.0 F F22 1 0.28969300 0.21463400 0.74781600 1.0 F F23 1 0.30856900 0.83015300 0.92975000 1.0 F F24 1 0.30699900 0.01871200 0.33987000 1.0 F F25 1 0.19767900 0.92271000 0.13859700 1.0 F F26 1 0.19284000 0.32484800 0.93811500 1.0 F F27 1 0.19302600 0.11680100 0.54152800 1.0 F F28 1 0.20482000 0.70716500 0.74013200 1.0 F F29 1 0.19573900 0.51769200 0.34063200 1.0