# generated using pymatgen data_AlBO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.31443590 _cell_length_b 5.31443590 _cell_length_c 5.31443592 _cell_angle_alpha 50.16091164 _cell_angle_beta 50.16091164 _cell_angle_gamma 50.16091429 _symmetry_Int_Tables_number 1 _chemical_formula_structural AlBO3 _chemical_formula_sum 'Al2 B2 O6' _cell_volume 81.46986382 _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 Al Al0 1 0.50000000 0.50000000 0.50000000 1.0 Al Al1 1 0.00000000 0.00000000 0.00000000 1.0 B B2 1 0.75000000 0.75000000 0.75000000 1.0 B B3 1 0.25000000 0.25000000 0.25000000 1.0 O O4 1 0.05790400 0.75000000 0.44209600 1.0 O O5 1 0.75000000 0.44209600 0.05790400 1.0 O O6 1 0.55790400 0.94209600 0.25000000 1.0 O O7 1 0.94209600 0.25000000 0.55790400 1.0 O O8 1 0.25000000 0.55790400 0.94209600 1.0 O O9 1 0.44209600 0.05790400 0.75000000 1.0