# generated using pymatgen data_Cr3Co2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.49359100 _cell_length_b 8.64322487 _cell_length_c 8.64322487 _cell_angle_alpha 90.70348521 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr3Co2 _chemical_formula_sum 'Cr18 Co12' _cell_volume 335.66992329 _cell_formula_units_Z 6 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 0.49880600 0.10309000 0.89691000 1.0 Cr Cr1 1 0.49880600 0.89691000 0.10309000 1.0 Cr Cr2 1 0.00287600 0.39316500 0.39316500 1.0 Cr Cr3 1 0.00287600 0.60683500 0.60683500 1.0 Cr Cr4 1 0.49754500 0.37314000 0.96032500 1.0 Cr Cr5 1 0.49754500 0.62686000 0.03967500 1.0 Cr Cr6 1 0.00122200 0.12987600 0.46596100 1.0 Cr Cr7 1 0.00122200 0.87012400 0.53403900 1.0 Cr Cr8 1 0.49754500 0.96032500 0.37314000 1.0 Cr Cr9 1 0.49754500 0.03967500 0.62686000 1.0 Cr Cr10 1 0.00122200 0.46596100 0.12987600 1.0 Cr Cr11 1 0.00122200 0.53403900 0.87012400 1.0 Cr Cr12 1 0.75081400 0.18315800 0.18315800 1.0 Cr Cr13 1 0.75081400 0.81684200 0.81684200 1.0 Cr Cr14 1 0.75125400 0.68070600 0.31929400 1.0 Cr Cr15 1 0.75125400 0.31929400 0.68070600 1.0 Cr Cr16 1 0.25101600 0.81793600 0.81793600 1.0 Cr Cr17 1 0.25101600 0.18206400 0.18206400 1.0 Co Co18 1 0.49603900 0.43460700 0.23891800 1.0 Co Co19 1 0.49603900 0.56539300 0.76108200 1.0 Co Co20 1 0.99978300 0.06597900 0.73831400 1.0 Co Co21 1 0.99978300 0.93402100 0.26168600 1.0 Co Co22 1 0.49603900 0.23891800 0.43460700 1.0 Co Co23 1 0.49603900 0.76108200 0.56539300 1.0 Co Co24 1 0.99978300 0.73831400 0.06597900 1.0 Co Co25 1 0.99978300 0.26168600 0.93402100 1.0 Co Co26 1 0.51130200 0.50000000 0.50000000 1.0 Co Co27 1 0.00102100 0.00000000 0.00000000 1.0 Co Co28 1 0.24989500 0.31551900 0.68448100 1.0 Co Co29 1 0.24989500 0.68448100 0.31551900 1.0