# generated using pymatgen data_Sc3P2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.72891481 _cell_length_b 10.17645414 _cell_length_c 10.07611198 _cell_angle_alpha 90.00005059 _cell_angle_beta 89.99999377 _cell_angle_gamma 90.00001878 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc3P2 _chemical_formula_sum 'Sc12 P8' _cell_volume 382.35953680 _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 0.74999939 0.77586912 0.19965649 1.0 Sc Sc1 1 0.24999877 0.22413372 0.80033905 1.0 Sc Sc2 1 0.74999974 0.27587691 0.30032343 1.0 Sc Sc3 1 0.25000012 0.72412095 0.69967564 1.0 Sc Sc4 1 0.25000017 0.87409566 0.43758329 1.0 Sc Sc5 1 0.74999968 0.12595805 0.56241356 1.0 Sc Sc6 1 0.25000047 0.37405799 0.06241597 1.0 Sc Sc7 1 0.75000004 0.62588876 0.93758594 1.0 Sc Sc8 1 0.25000011 0.54669964 0.36682996 1.0 Sc Sc9 1 0.75000011 0.45323148 0.63317188 1.0 Sc Sc10 1 0.25000021 0.04676390 0.13316682 1.0 Sc Sc11 1 0.74999999 0.95330567 0.86682870 1.0 P P12 1 0.25000011 0.98839043 0.67946919 1.0 P P13 1 0.75000004 0.01166352 0.32052757 1.0 P P14 1 0.25000036 0.48833581 0.82052798 1.0 P P15 1 0.75000038 0.51160760 0.17947912 1.0 P P16 1 0.25000012 0.81375506 0.00259150 1.0 P P17 1 0.74999972 0.18625786 0.99740710 1.0 P P18 1 0.25000012 0.31375185 0.49739506 1.0 P P19 1 0.75000034 0.68623702 0.50260775 1.0