# generated using pymatgen data_Sc10(GaAs)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.95793951 _cell_length_b 7.94149946 _cell_length_c 5.91772089 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.06850347 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc10(GaAs)3 _chemical_formula_sum 'Sc10 Ga3 As3' _cell_volume 323.65927118 _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 0.33166669 0.66586739 0.00136543 1.0 Sc Sc1 1 0.66580030 0.33413261 0.49863457 1.0 Sc Sc2 1 0.66580030 0.33413261 0.00136543 1.0 Sc Sc3 1 0.33166669 0.66586739 0.49863457 1.0 Sc Sc4 1 0.23962128 0.00000000 0.25000000 1.0 Sc Sc5 1 0.24037496 0.23825775 0.75000000 1.0 Sc Sc6 1 0.00211721 0.76174225 0.75000000 1.0 Sc Sc7 1 0.00242825 0.24155791 0.25000000 1.0 Sc Sc8 1 0.76087034 0.75844209 0.25000000 1.0 Sc Sc9 1 0.75758767 0.00000000 0.75000000 1.0 Ga Ga10 1 0.99853663 0.60457535 0.25000000 1.0 Ga Ga11 1 0.39396128 0.39542465 0.25000000 1.0 Ga Ga12 1 0.39535502 0.00000000 0.75000000 1.0 As As13 1 0.60893836 0.00000000 0.25000000 1.0 As As14 1 0.60734034 0.60940366 0.75000000 1.0 As As15 1 0.99793667 0.39059634 0.75000000 1.0