# generated using pymatgen data_Cr3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.81084888 _cell_length_b 5.81084888 _cell_length_c 10.20799700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00001000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr3O8 _chemical_formula_sum 'Cr6 O16' _cell_volume 298.50408834 _cell_formula_units_Z 2 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 Cr Cr0 1 0.66599900 0.83299900 0.25009000 1.0 Cr Cr1 1 0.83299900 0.16700100 0.75009000 1.0 Cr Cr2 1 0.16700100 0.33400100 0.25009000 1.0 Cr Cr3 1 0.83299900 0.66599900 0.75009000 1.0 Cr Cr4 1 0.33400100 0.16700100 0.75009000 1.0 Cr Cr5 1 0.16700100 0.83299900 0.25009000 1.0 O O6 1 0.85007200 0.14992800 0.15526000 1.0 O O7 1 0.70014300 0.85007200 0.65526000 1.0 O O8 1 0.14992800 0.29985700 0.65526000 1.0 O O9 1 0.85007200 0.70014300 0.15526000 1.0 O O10 1 0.29985700 0.14992800 0.15526000 1.0 O O11 1 0.14992800 0.85007200 0.65526000 1.0 O O12 1 0.51720800 0.48279200 0.84637100 1.0 O O13 1 0.03441600 0.51720800 0.34637100 1.0 O O14 1 0.48279200 0.96558400 0.34637100 1.0 O O15 1 0.51720800 0.03441600 0.84637100 1.0 O O16 1 0.00000000 0.00000000 0.34901200 1.0 O O17 1 0.00000000 0.00000000 0.84901200 1.0 O O18 1 0.33333300 0.66666700 0.15097100 1.0 O O19 1 0.96558400 0.48279200 0.84637100 1.0 O O20 1 0.48279200 0.51720800 0.34637100 1.0 O O21 1 0.66666700 0.33333300 0.65097100 1.0