# generated using pymatgen data_Ca3Th(InPt)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.44947271 _cell_length_b 7.23967493 _cell_length_c 8.45290464 _cell_angle_alpha 90.69995775 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca3Th(InPt)4 _chemical_formula_sum 'Ca3 Th1 In4 Pt4' _cell_volume 272.27086740 _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 Ca Ca0 1 0.25000000 0.53425594 0.17590453 1.0 Ca Ca1 1 0.75000000 0.96395056 0.68370067 1.0 Ca Ca2 1 0.75000000 0.46064477 0.82246358 1.0 Th Th3 1 0.25000000 0.03794771 0.32693005 1.0 In In4 1 0.75000000 0.37307061 0.44021807 1.0 In In5 1 0.25000000 0.14357937 0.93360328 1.0 In In6 1 0.75000000 0.84506309 0.05519170 1.0 In In7 1 0.25000000 0.64340377 0.56364273 1.0 Pt Pt8 1 0.75000000 0.22519753 0.13464188 1.0 Pt Pt9 1 0.75000000 0.75880114 0.37169910 1.0 Pt Pt10 1 0.25000000 0.75806504 0.87533303 1.0 Pt Pt11 1 0.25000000 0.25602048 0.61666938 1.0