# generated using pymatgen data_Zr2Pa3FeSb3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.96180357 _cell_length_b 8.96180421 _cell_length_c 5.96917722 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000131 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr2Pa3FeSb3 _chemical_formula_sum 'Zr4 Pa6 Fe2 Sb6' _cell_volume 415.17956643 _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 Zr Zr0 1 0.66666700 0.33333300 0.00000000 1.0 Zr Zr1 1 0.33333300 0.66666700 0.00000000 1.0 Zr Zr2 1 0.33333300 0.66666700 0.50000000 1.0 Zr Zr3 1 0.66666700 0.33333300 0.50000000 1.0 Pa Pa4 1 0.75635985 0.75635985 0.75000000 1.0 Pa Pa5 1 0.24364015 1.00000000 0.75000000 1.0 Pa Pa6 1 0.00000000 0.24364015 0.75000000 1.0 Pa Pa7 1 0.24364015 0.24364015 0.25000000 1.0 Pa Pa8 1 0.75635985 0.00000000 0.25000000 1.0 Pa Pa9 1 1.00000000 0.75635985 0.25000000 1.0 Fe Fe10 1 0.00000000 0.00000000 0.00000000 1.0 Fe Fe11 1 0.00000000 0.00000000 0.50000000 1.0 Sb Sb12 1 0.39907098 0.39907098 0.75000000 1.0 Sb Sb13 1 0.60092902 0.00000000 0.75000000 1.0 Sb Sb14 1 1.00000000 0.60092902 0.75000000 1.0 Sb Sb15 1 0.60092902 0.60092902 0.25000000 1.0 Sb Sb16 1 0.39907098 1.00000000 0.25000000 1.0 Sb Sb17 1 0.00000000 0.39907098 0.25000000 1.0