# generated using pymatgen data_Al(HO)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.86588500 _cell_length_b 5.04203056 _cell_length_c 9.74343682 _cell_angle_alpha 90.03700105 _cell_angle_beta 90.84259869 _cell_angle_gamma 90.12267050 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al(HO)3 _chemical_formula_sum 'Al8 H24 O24' _cell_volume 435.50353182 _cell_formula_units_Z 8 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 0.01913100 0.32856000 0.50293900 1.0 Al Al1 1 0.46785900 0.83837500 0.00045400 1.0 Al Al2 1 0.96016000 0.66069900 0.49891900 1.0 Al Al3 1 0.52504900 0.17166900 0.99981700 1.0 Al Al4 1 0.51193300 0.15737600 0.50327000 1.0 Al Al5 1 0.97418500 0.66660300 0.00277900 1.0 Al Al6 1 0.46483100 0.83025900 0.49887600 1.0 Al Al7 1 0.02127100 0.34111000 0.00052800 1.0 H H8 1 0.62754300 0.40667700 0.62603900 1.0 H H9 1 0.86436500 0.91627900 0.12202600 1.0 H H10 1 0.38476500 0.59767200 0.36972000 1.0 H H11 1 0.10131300 0.10860900 0.86866800 1.0 H H12 1 0.15928600 0.80886700 0.70148700 1.0 H H13 1 0.32948100 0.32067400 0.20311000 1.0 H H14 1 0.94269300 0.07905500 0.39513400 1.0 H H15 1 0.54111500 0.58830100 0.89711100 1.0 H H16 1 0.82054100 0.97313800 0.60626400 1.0 H H17 1 0.66281900 0.48399500 0.10771800 1.0 H H18 1 0.38948100 0.00036100 0.29794000 1.0 H H19 1 0.09105000 0.50545800 0.79798700 1.0 H H20 1 0.30523900 0.53665000 0.61865900 1.0 H H21 1 0.18523500 0.04872000 0.11890300 1.0 H H22 1 0.87066500 0.48290500 0.29921700 1.0 H H23 1 0.60919200 0.99245600 0.79614700 1.0 H H24 1 0.21729000 0.20518800 0.70435000 1.0 H H25 1 0.27494800 0.70352200 0.20472500 1.0 H H26 1 0.77281800 0.79456900 0.29280300 1.0 H H27 1 0.71451200 0.29460000 0.79605200 1.0 H H28 1 0.65942000 0.68534700 0.70647100 1.0 H H29 1 0.83074400 0.19141100 0.20733300 1.0 H H30 1 0.48210700 0.39554000 0.39319400 1.0 H H31 1 0.00033500 0.89938800 0.88717800 1.0 O O32 1 0.70605300 0.30703200 0.61556000 1.0 O O33 1 0.78035800 0.81810900 0.11192600 1.0 O O34 1 0.27282200 0.68551000 0.38443400 1.0 O O35 1 0.21160400 0.19641700 0.88620200 1.0 O O36 1 0.14676400 0.81475500 0.60069200 1.0 O O37 1 0.34034700 0.32824800 0.10255900 1.0 O O38 1 0.83772700 0.17222000 0.39877500 1.0 O O39 1 0.64903000 0.68068500 0.89612900 1.0 O O40 1 0.62815200 0.98921200 0.61154000 1.0 O O41 1 0.85559300 0.49963200 0.11227200 1.0 O O42 1 0.35629100 0.00034000 0.39785600 1.0 O O43 1 0.12712600 0.50993100 0.89755400 1.0 O O44 1 0.11989700 0.50471900 0.61017600 1.0 O O45 1 0.36909200 0.01564800 0.10913700 1.0 O O46 1 0.84235200 0.48080600 0.39980200 1.0 O O47 1 0.64125500 0.99226200 0.89676200 1.0 O O48 1 0.20083500 0.18628100 0.60482800 1.0 O O49 1 0.28557600 0.69662700 0.10371400 1.0 O O50 1 0.77501300 0.79796200 0.39438300 1.0 O O51 1 0.71083600 0.30855300 0.89649900 1.0 O O52 1 0.64030900 0.66897100 0.60590500 1.0 O O53 1 0.84647600 0.17952600 0.10645300 1.0 O O54 1 0.34410300 0.31601900 0.39222500 1.0 O O55 1 0.14065900 0.82242900 0.89140600 1.0