# generated using pymatgen data_Sc2Co12P7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.95679698 _cell_length_b 8.95679698 _cell_length_c 3.53730300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000721 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2Co12P7 _chemical_formula_sum 'Sc2 Co12 P7' _cell_volume 245.75837284 _cell_formula_units_Z 1 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 0.66666700 0.33333300 0.00000000 1.0 Sc Sc1 1 0.00000000 0.00000000 0.50000000 1.0 Co Co2 1 0.77164600 0.04220500 0.00000000 1.0 Co Co3 1 0.95779500 0.72944100 0.00000000 1.0 Co Co4 1 0.27055900 0.22835400 0.00000000 1.0 Co Co5 1 0.48822300 0.54594000 0.00000000 1.0 Co Co6 1 0.45406000 0.94228300 0.00000000 1.0 Co Co7 1 0.05771700 0.51177700 0.00000000 1.0 Co Co8 1 0.71528100 0.61129600 0.50000000 1.0 Co Co9 1 0.38870400 0.10398500 0.50000000 1.0 Co Co10 1 0.89601500 0.28471900 0.50000000 1.0 Co Co11 1 0.56687200 0.79872800 0.50000000 1.0 Co Co12 1 0.20127200 0.76814500 0.50000000 1.0 Co Co13 1 0.23185500 0.43312800 0.50000000 1.0 P P14 1 0.74286900 0.78386300 0.00000000 1.0 P P15 1 0.21613700 0.95900600 0.00000000 1.0 P P16 1 0.04099400 0.25713100 0.00000000 1.0 P P17 1 0.44887200 0.37386100 0.50000000 1.0 P P18 1 0.62613900 0.07501100 0.50000000 1.0 P P19 1 0.92498900 0.55112800 0.50000000 1.0 P P20 1 0.33333300 0.66666700 0.00000000 1.0