# generated using pymatgen data_Sc8Si4Ir5Pt9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.04974121 _cell_length_b 6.48918303 _cell_length_c 15.89054843 _cell_angle_alpha 90.06515809 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc8Si4Ir5Pt9 _chemical_formula_sum 'Sc8 Si4 Ir5 Pt9' _cell_volume 417.59558691 _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 0.00000000 0.28229040 0.46173740 1.0 Sc Sc1 1 0.00000000 0.71770960 0.53826260 1.0 Sc Sc2 1 0.00000000 0.77742900 0.03694116 1.0 Sc Sc3 1 0.00000000 0.22257100 0.96305884 1.0 Sc Sc4 1 0.00000000 0.53418427 0.29018008 1.0 Sc Sc5 1 0.00000000 0.46581573 0.70981992 1.0 Sc Sc6 1 0.00000000 0.03173855 0.20721454 1.0 Sc Sc7 1 0.00000000 0.96826145 0.79278546 1.0 Si Si8 1 0.50000000 0.84532080 0.30533066 1.0 Si Si9 1 0.50000000 0.15467920 0.69466934 1.0 Si Si10 1 0.50000000 0.34461392 0.19396821 1.0 Si Si11 1 0.50000000 0.65538608 0.80603179 1.0 Ir Ir12 1 0.00000000 0.90498040 0.37902976 1.0 Ir Ir13 1 0.00000000 0.09501960 0.62097024 1.0 Ir Ir14 1 0.00000000 0.40476310 0.12064846 1.0 Ir Ir15 1 0.00000000 0.59523690 0.87935154 1.0 Ir Ir16 1 0.50000000 0.50000000 0.00000000 1.0 Pt Pt17 1 0.50000000 0.60274288 0.42203452 1.0 Pt Pt18 1 0.50000000 0.39725712 0.57796548 1.0 Pt Pt19 1 0.50000000 0.10392840 0.07753591 1.0 Pt Pt20 1 0.50000000 0.89607160 0.92246409 1.0 Pt Pt21 1 0.50000000 0.00000000 0.50000000 1.0 Pt Pt22 1 0.50000000 0.21505247 0.33555208 1.0 Pt Pt23 1 0.50000000 0.78494753 0.66444792 1.0 Pt Pt24 1 0.50000000 0.71346118 0.16294262 1.0 Pt Pt25 1 0.50000000 0.28653882 0.83705738 1.0