# generated using pymatgen data_PaSi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.89375637 _cell_length_b 5.89375637 _cell_length_c 4.47571205 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000905 _symmetry_Int_Tables_number 1 _chemical_formula_structural PaSi3 _chemical_formula_sum 'Pa2 Si6' _cell_volume 134.64092556 _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 Pa Pa0 1 0.66666700 0.33333300 0.25000000 1.0 Pa Pa1 1 0.33333300 0.66666700 0.75000000 1.0 Si Si2 1 0.85727410 0.14272590 0.75000000 1.0 Si Si3 1 0.28545279 0.14272590 0.75000000 1.0 Si Si4 1 0.85727410 0.71454721 0.75000000 1.0 Si Si5 1 0.14273014 0.85726986 0.25000000 1.0 Si Si6 1 0.71453872 0.85726986 0.25000000 1.0 Si Si7 1 0.14273014 0.28546128 0.25000000 1.0