# generated using pymatgen data_Al11O18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 22.86009600 _cell_length_b 5.65138800 _cell_length_c 5.66263466 _cell_angle_alpha 60.12364367 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al11O18 _chemical_formula_sum 'Al22 O36' _cell_volume 634.33999863 _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 0.52466100 0.33329700 0.33366100 1.0 Al Al1 1 0.47533900 0.66670300 0.66633900 1.0 Al Al2 1 0.02466100 0.66670300 0.66633900 1.0 Al Al3 1 0.97533900 0.33329700 0.33366100 1.0 Al Al4 1 0.60677300 0.83264900 0.33384000 1.0 Al Al5 1 0.60686600 0.83288600 0.83248400 1.0 Al Al6 1 0.60699600 0.33472300 0.83205600 1.0 Al Al7 1 0.39322700 0.16735100 0.66616000 1.0 Al Al8 1 0.39313400 0.16711400 0.16751600 1.0 Al Al9 1 0.39300400 0.66527700 0.16794400 1.0 Al Al10 1 0.10677300 0.16735100 0.66616000 1.0 Al Al11 1 0.10686600 0.16711400 0.16751600 1.0 Al Al12 1 0.10699600 0.66527700 0.16794400 1.0 Al Al13 1 0.89322700 0.83264900 0.33384000 1.0 Al Al14 1 0.89313400 0.83288600 0.83248400 1.0 Al Al15 1 0.89300400 0.33472300 0.83205600 1.0 Al Al16 1 0.50000000 0.00000000 0.00000000 1.0 Al Al17 1 0.00000000 0.00000000 0.00000000 1.0 Al Al18 1 0.67539700 0.33195600 0.33166600 1.0 Al Al19 1 0.32460300 0.66804400 0.66833400 1.0 Al Al20 1 0.17539700 0.66804400 0.66833400 1.0 Al Al21 1 0.82460300 0.33195600 0.33166600 1.0 O O22 1 0.64044500 0.99999900 0.00041700 1.0 O O23 1 0.35955500 0.00000100 0.99958300 1.0 O O24 1 0.14044500 0.00000100 0.99958300 1.0 O O25 1 0.85955500 0.99999900 0.00041700 1.0 O O26 1 0.54953400 0.15781500 0.68479900 1.0 O O27 1 0.54935200 0.15728300 0.15755200 1.0 O O28 1 0.54943700 0.68508700 0.15782400 1.0 O O29 1 0.45046600 0.84218500 0.31520100 1.0 O O30 1 0.45064800 0.84271700 0.84244800 1.0 O O31 1 0.45056300 0.31491300 0.84217600 1.0 O O32 1 0.04953400 0.84218500 0.31520100 1.0 O O33 1 0.04935200 0.84271700 0.84244800 1.0 O O34 1 0.04943700 0.31491300 0.84217600 1.0 O O35 1 0.95046600 0.15781500 0.68479900 1.0 O O36 1 0.95064800 0.15728300 0.15755200 1.0 O O37 1 0.95056300 0.68508700 0.15782400 1.0 O O38 1 0.55562900 0.66638500 0.66623900 1.0 O O39 1 0.44437100 0.33361500 0.33376100 1.0 O O40 1 0.05562900 0.33361500 0.33376100 1.0 O O41 1 0.94437100 0.66638500 0.66623900 1.0 O O42 1 0.64445300 0.50127400 0.99803700 1.0 O O43 1 0.64517200 0.50125500 0.50085200 1.0 O O44 1 0.64447300 0.99665400 0.50188700 1.0 O O45 1 0.35554700 0.49872600 0.00196300 1.0 O O46 1 0.35482800 0.49874500 0.49914800 1.0 O O47 1 0.35552700 0.00334600 0.49811300 1.0 O O48 1 0.14445300 0.49872600 0.00196300 1.0 O O49 1 0.14517200 0.49874500 0.49914800 1.0 O O50 1 0.14447300 0.00334600 0.49811300 1.0 O O51 1 0.85554700 0.50127400 0.99803700 1.0 O O52 1 0.85482800 0.50125500 0.50085200 1.0 O O53 1 0.85552700 0.99665400 0.50188700 1.0 O O54 1 0.75000000 0.70940300 0.58945100 1.0 O O55 1 0.25000000 0.29059700 0.41054900 1.0 O O56 1 0.75000000 0.31805600 0.32540600 1.0 O O57 1 0.25000000 0.68194400 0.67459400 1.0