# generated using pymatgen data_MgUReB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.60535246 _cell_length_b 8.88028466 _cell_length_c 11.24340150 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgUReB6 _chemical_formula_sum 'Mg4 U4 Re4 B24' _cell_volume 359.97499538 _cell_formula_units_Z 4 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 Mg Mg0 1 0.00000000 0.94594090 0.37734789 1.0 Mg Mg1 1 0.00000000 0.05405910 0.62265211 1.0 Mg Mg2 1 0.00000000 0.44594090 0.12265211 1.0 Mg Mg3 1 0.00000000 0.55405910 0.87734789 1.0 U U4 1 0.00000000 0.32038951 0.41313957 1.0 U U5 1 0.00000000 0.67961049 0.58686043 1.0 U U6 1 0.00000000 0.82038951 0.08686043 1.0 U U7 1 0.00000000 0.17961049 0.91313957 1.0 Re Re8 1 0.00000000 0.63995548 0.31932147 1.0 Re Re9 1 0.00000000 0.36004452 0.68067853 1.0 Re Re10 1 0.00000000 0.13995548 0.18067853 1.0 Re Re11 1 0.00000000 0.86004452 0.81932147 1.0 B B12 1 0.50000000 0.55435085 0.43348098 1.0 B B13 1 0.50000000 0.44564915 0.56651902 1.0 B B14 1 0.50000000 0.05435085 0.06651902 1.0 B B15 1 0.50000000 0.94564915 0.93348098 1.0 B B16 1 0.50000000 0.75436136 0.41939520 1.0 B B17 1 0.50000000 0.24563864 0.58060480 1.0 B B18 1 0.50000000 0.25436136 0.08060480 1.0 B B19 1 0.50000000 0.74563864 0.91939520 1.0 B B20 1 0.50000000 0.79330487 0.26338503 1.0 B B21 1 0.50000000 0.20669513 0.73661497 1.0 B B22 1 0.50000000 0.29330487 0.23661497 1.0 B B23 1 0.50000000 0.70669513 0.76338503 1.0 B B24 1 0.50000000 0.62838945 0.18229055 1.0 B B25 1 0.50000000 0.37161055 0.81770945 1.0 B B26 1 0.50000000 0.12838945 0.31770945 1.0 B B27 1 0.50000000 0.87161055 0.68229055 1.0 B B28 1 0.50000000 0.98057209 0.21285627 1.0 B B29 1 0.50000000 0.01942791 0.78714373 1.0 B B30 1 0.50000000 0.48057209 0.28714373 1.0 B B31 1 0.50000000 0.51942791 0.71285627 1.0 B B32 1 0.50000000 0.59961211 0.02752035 1.0 B B33 1 0.50000000 0.40038789 0.97247965 1.0 B B34 1 0.50000000 0.09961211 0.47247965 1.0 B B35 1 0.50000000 0.90038789 0.52752035 1.0