# generated using pymatgen data_Al13Si5ClO38 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.88732139 _cell_length_b 9.88732139 _cell_length_c 9.88732139 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al13Si5ClO38 _chemical_formula_sum 'Al13 Si5 Cl1 O38' _cell_volume 683.47235883 _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 Al Al0 1 0.76747700 0.40071500 0.06433000 1.0 Al Al1 1 0.76747700 0.76747700 0.06433000 1.0 Al Al2 1 0.40071500 0.76747700 0.06433000 1.0 Al Al3 1 0.76747700 0.06433000 0.40071500 1.0 Al Al4 1 0.40071500 0.06433000 0.76747700 1.0 Al Al5 1 0.76747700 0.06433000 0.76747700 1.0 Al Al6 1 0.06433000 0.76747700 0.76747700 1.0 Al Al7 1 0.06433000 0.40071500 0.76747700 1.0 Al Al8 1 0.06433000 0.76747700 0.40071500 1.0 Al Al9 1 0.40071500 0.76747700 0.76747700 1.0 Al Al10 1 0.76747700 0.76747700 0.40071500 1.0 Al Al11 1 0.76747700 0.40071500 0.76747700 1.0 Al Al12 1 0.75000000 0.75000000 0.75000000 1.0 Si Si13 1 0.11631300 0.11631300 0.65106000 1.0 Si Si14 1 0.11631300 0.65106000 0.11631300 1.0 Si Si15 1 0.65106000 0.11631300 0.11631300 1.0 Si Si16 1 0.11631300 0.11631300 0.11631300 1.0 Si Si17 1 0.25000000 0.25000000 0.25000000 1.0 Cl Cl18 1 0.50000000 0.50000000 0.50000000 1.0 O O19 1 0.82539100 0.82539100 0.52382700 1.0 O O20 1 0.82539100 0.52382700 0.82539100 1.0 O O21 1 0.52382700 0.82539100 0.82539100 1.0 O O22 1 0.82539100 0.82539100 0.82539100 1.0 O O23 1 0.18318400 0.18318400 0.45044800 1.0 O O24 1 0.18318400 0.45044800 0.18318400 1.0 O O25 1 0.45044800 0.18318400 0.18318400 1.0 O O26 1 0.18318400 0.18318400 0.18318400 1.0 O O27 1 0.28020800 0.28020800 0.71979200 1.0 O O28 1 0.71979200 0.28020800 0.71979200 1.0 O O29 1 0.28020800 0.71979200 0.71979200 1.0 O O30 1 0.71979200 0.71979200 0.28020800 1.0 O O31 1 0.28020800 0.71979200 0.28020800 1.0 O O32 1 0.71979200 0.28020800 0.28020800 1.0 O O33 1 0.55517400 0.79617400 0.09347800 1.0 O O34 1 0.55517400 0.55517400 0.09347800 1.0 O O35 1 0.79617400 0.55517400 0.09347800 1.0 O O36 1 0.55517400 0.09347800 0.79617400 1.0 O O37 1 0.79617400 0.09347800 0.55517400 1.0 O O38 1 0.55517400 0.09347800 0.55517400 1.0 O O39 1 0.09347800 0.55517400 0.55517400 1.0 O O40 1 0.09347800 0.79617400 0.55517400 1.0 O O41 1 0.09347800 0.55517400 0.79617400 1.0 O O42 1 0.79617400 0.55517400 0.55517400 1.0 O O43 1 0.55517400 0.55517400 0.79617400 1.0 O O44 1 0.55517400 0.79617400 0.55517400 1.0 O O45 1 0.00221800 0.27580400 0.71975900 1.0 O O46 1 0.00221800 0.00221800 0.71975900 1.0 O O47 1 0.27580400 0.00221800 0.71975900 1.0 O O48 1 0.00221800 0.71975900 0.27580400 1.0 O O49 1 0.27580400 0.71975900 0.00221800 1.0 O O50 1 0.00221800 0.71975900 0.00221800 1.0 O O51 1 0.71975900 0.00221800 0.00221800 1.0 O O52 1 0.71975900 0.27580400 0.00221800 1.0 O O53 1 0.71975900 0.00221800 0.27580400 1.0 O O54 1 0.27580400 0.00221800 0.00221800 1.0 O O55 1 0.00221800 0.00221800 0.27580400 1.0 O O56 1 0.00221800 0.27580400 0.00221800 1.0