# generated using pymatgen data_Ca4Fe3As8Pt _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.93726100 _cell_length_b 3.93726100 _cell_length_c 20.28954800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca4Fe3As8Pt _chemical_formula_sum 'Ca4 Fe3 As8 Pt1' _cell_volume 314.52906374 _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 0.50000000 0.00000000 0.13569000 1.0 Ca Ca1 1 0.50000000 0.00000000 0.63144200 1.0 Ca Ca2 1 0.00000000 0.50000000 0.36855800 1.0 Ca Ca3 1 0.00000000 0.50000000 0.86431000 1.0 Fe Fe4 1 0.50000000 0.50000000 0.50000000 1.0 Fe Fe5 1 0.00000000 0.00000000 0.00000000 1.0 Fe Fe6 1 0.00000000 0.00000000 0.50000000 1.0 As As7 1 0.50000000 0.50000000 0.25082800 1.0 As As8 1 0.50000000 0.50000000 0.74917200 1.0 As As9 1 0.00000000 0.00000000 0.25167100 1.0 As As10 1 0.00000000 0.00000000 0.74832900 1.0 As As11 1 0.50000000 0.00000000 0.43809200 1.0 As As12 1 0.50000000 0.00000000 0.92754200 1.0 As As13 1 0.00000000 0.50000000 0.07245800 1.0 As As14 1 0.00000000 0.50000000 0.56190800 1.0 Pt Pt15 1 0.50000000 0.50000000 0.00000000 1.0