# generated using pymatgen data_Sc2Co4P3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.98434060 _cell_length_b 11.98434029 _cell_length_c 3.62115865 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000353 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2Co4P3 _chemical_formula_sum 'Sc8 Co16 P12' _cell_volume 450.40836168 _cell_formula_units_Z 4 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 Sc Sc0 1 0.81655814 0.81655814 0.50000000 1.0 Sc Sc1 1 0.44157305 0.44157305 0.00000000 1.0 Sc Sc2 1 1.00000000 0.18344186 0.50000000 1.0 Sc Sc3 1 0.55842695 0.00000000 0.00000000 1.0 Sc Sc4 1 0.33333300 0.66666700 0.00000000 1.0 Sc Sc5 1 0.66666700 0.33333300 0.00000000 1.0 Sc Sc6 1 0.00000000 0.55842695 0.00000000 1.0 Sc Sc7 1 0.18344186 1.00000000 0.50000000 1.0 Co Co8 1 0.62827441 0.82155771 0.00000000 1.0 Co Co9 1 0.37172559 0.19328330 0.00000000 1.0 Co Co10 1 0.00000000 0.72295281 0.50000000 1.0 Co Co11 1 0.27704719 0.27704719 0.50000000 1.0 Co Co12 1 0.87405136 0.35516888 0.50000000 1.0 Co Co13 1 0.72295281 0.00000000 0.50000000 1.0 Co Co14 1 0.82155771 0.62827441 0.00000000 1.0 Co Co15 1 0.17844229 0.80671670 0.00000000 1.0 Co Co16 1 0.35516888 0.87405136 0.50000000 1.0 Co Co17 1 0.12594864 0.48111751 0.50000000 1.0 Co Co18 1 0.64483112 0.51888249 0.50000000 1.0 Co Co19 1 0.00000000 0.00000000 0.00000000 1.0 Co Co20 1 0.51888249 0.64483112 0.50000000 1.0 Co Co21 1 0.48111751 0.12594864 0.50000000 1.0 Co Co22 1 0.19328330 0.37172559 0.00000000 1.0 Co Co23 1 0.80671670 0.17844229 0.00000000 1.0 P P24 1 0.00000000 0.35033462 0.00000000 1.0 P P25 1 0.82613322 0.51751306 0.50000000 1.0 P P26 1 0.69137885 0.17386678 0.50000000 1.0 P P27 1 0.17654468 0.17654468 0.00000000 1.0 P P28 1 0.64966538 0.64966538 0.00000000 1.0 P P29 1 0.82345532 1.00000000 0.00000000 1.0 P P30 1 0.51751306 0.82613322 0.50000000 1.0 P P31 1 0.17386678 0.69137885 0.50000000 1.0 P P32 1 0.35033462 0.00000000 0.00000000 1.0 P P33 1 0.48248694 0.30862115 0.50000000 1.0 P P34 1 1.00000000 0.82345532 0.00000000 1.0 P P35 1 0.30862115 0.48248694 0.50000000 1.0