# generated using pymatgen data_AsPt3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.58704174 _cell_length_b 5.58704174 _cell_length_c 4.77086500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999688 _symmetry_Int_Tables_number 1 _chemical_formula_structural AsPt3 _chemical_formula_sum 'As2 Pt6' _cell_volume 128.97086252 _cell_formula_units_Z 2 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 As As0 1 0.33333300 0.66666700 0.75000000 1.0 As As1 1 0.66666700 0.33333300 0.25000000 1.0 Pt Pt2 1 0.16647000 0.33294000 0.25000000 1.0 Pt Pt3 1 0.66706000 0.83353000 0.25000000 1.0 Pt Pt4 1 0.16647000 0.83353000 0.25000000 1.0 Pt Pt5 1 0.83353000 0.66706000 0.75000000 1.0 Pt Pt6 1 0.33294000 0.16647000 0.75000000 1.0 Pt Pt7 1 0.83353000 0.16647000 0.75000000 1.0