# generated using pymatgen data_Be3Nb4Al5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.91142420 _cell_length_b 4.91142309 _cell_length_c 8.10670775 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 60.59641115 _symmetry_Int_Tables_number 1 _chemical_formula_structural Be3Nb4Al5 _chemical_formula_sum 'Be3 Nb4 Al5' _cell_volume 170.36043203 _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 Be Be0 1 0.83242418 0.83242318 0.75000000 1.0 Be Be1 1 0.19045676 0.65182802 0.25000000 1.0 Be Be2 1 0.65182602 0.19045876 0.25000000 1.0 Nb Nb3 1 0.33373415 0.33373515 0.56101673 1.0 Nb Nb4 1 0.66344105 0.66344105 0.43429486 1.0 Nb Nb5 1 0.66344105 0.66344105 0.06570514 1.0 Nb Nb6 1 0.33373415 0.33373515 0.93898327 1.0 Al Al7 1 0.98557681 0.98557481 0.49057722 1.0 Al Al8 1 0.98557681 0.98557481 0.00942278 1.0 Al Al9 1 0.83401373 0.34521450 0.75000000 1.0 Al Al10 1 0.34521750 0.83401073 0.75000000 1.0 Al Al11 1 0.18055981 0.18056081 0.25000000 1.0