# generated using pymatgen data_PaGaFe2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.49659143 _cell_length_b 4.49685258 _cell_length_c 4.49695937 _cell_angle_alpha 59.99255881 _cell_angle_beta 60.00048685 _cell_angle_gamma 60.00296774 _symmetry_Int_Tables_number 1 _chemical_formula_structural PaGaFe2 _chemical_formula_sum 'Pa1 Ga1 Fe2' _cell_volume 64.29585152 _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 Pa Pa0 1 0.75000063 0.75000028 0.75000019 1.0 Ga Ga1 1 0.25000092 0.24999757 0.25000137 1.0 Fe Fe2 1 0.99996573 0.99996515 0.00000384 1.0 Fe Fe3 1 0.50003171 0.50003701 0.49999359 1.0