# generated using pymatgen data_Pa(MnRe2)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.80972179 _cell_length_b 6.78038876 _cell_length_c 6.78038863 _cell_angle_alpha 82.77318991 _cell_angle_beta 69.22624165 _cell_angle_gamma 69.22623290 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pa(MnRe2)4 _chemical_formula_sum 'Pa1 Mn4 Re8' _cell_volume 193.30424428 _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 0.00000000 0.00000000 0.00000000 1.0 Mn Mn1 1 0.00000000 0.00000000 0.50000000 1.0 Mn Mn2 1 0.50000000 0.00000000 0.50000000 1.0 Mn Mn3 1 0.50000000 0.50000000 0.00000000 1.0 Mn Mn4 1 0.00000000 0.50000000 0.00000000 1.0 Re Re5 1 1.00000000 0.35752095 0.64247905 1.0 Re Re6 1 0.00000000 0.64247905 0.35752095 1.0 Re Re7 1 0.64247905 0.35752095 0.35752095 1.0 Re Re8 1 0.35752095 0.64247905 0.64247905 1.0 Re Re9 1 0.50000000 0.78337133 0.21662867 1.0 Re Re10 1 0.50000000 0.21662867 0.78337133 1.0 Re Re11 1 0.71662867 0.78337133 0.78337133 1.0 Re Re12 1 0.28337133 0.21662867 0.21662867 1.0