# generated using pymatgen data_Sb8Cl2O21 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.31615143 _cell_length_b 12.31615143 _cell_length_c 20.68993589 _cell_angle_alpha 48.73541756 _cell_angle_beta 48.73541756 _cell_angle_gamma 27.94133149 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sb8Cl2O21 _chemical_formula_sum 'Sb16 Cl4 O42' _cell_volume 1078.71722900 _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 Sb Sb0 1 0.49703900 0.86297400 0.35519900 1.0 Sb Sb1 1 0.86297400 0.49703900 0.85519900 1.0 Sb Sb2 1 0.50296100 0.13702600 0.64480100 1.0 Sb Sb3 1 0.13702600 0.50296100 0.14480100 1.0 Sb Sb4 1 0.23341200 0.66359900 0.50432700 1.0 Sb Sb5 1 0.66359900 0.23341200 0.00432700 1.0 Sb Sb6 1 0.76658800 0.33640100 0.49567300 1.0 Sb Sb7 1 0.33640100 0.76658800 0.99567300 1.0 Sb Sb8 1 0.09731400 0.72376800 0.70423700 1.0 Sb Sb9 1 0.72376800 0.09731400 0.20423700 1.0 Sb Sb10 1 0.90268600 0.27623200 0.29576300 1.0 Sb Sb11 1 0.27623200 0.90268600 0.79576300 1.0 Sb Sb12 1 0.42816400 0.98653500 0.16313900 1.0 Sb Sb13 1 0.98653500 0.42816400 0.66313900 1.0 Sb Sb14 1 0.57183600 0.01346500 0.83686100 1.0 Sb Sb15 1 0.01346500 0.57183600 0.33686100 1.0 Cl Cl16 1 0.93847200 0.32289000 0.06872900 1.0 Cl Cl17 1 0.32289000 0.93847200 0.56872900 1.0 Cl Cl18 1 0.06152800 0.67711000 0.93127100 1.0 Cl Cl19 1 0.67711000 0.06152800 0.43127100 1.0 O O20 1 0.19076900 0.45870400 0.60617900 1.0 O O21 1 0.45870400 0.19076900 0.10617900 1.0 O O22 1 0.80923100 0.54129600 0.39382100 1.0 O O23 1 0.54129600 0.80923100 0.89382100 1.0 O O24 1 0.47135800 0.65237100 0.44146400 1.0 O O25 1 0.65237100 0.47135800 0.94146400 1.0 O O26 1 0.52864200 0.34762900 0.55853600 1.0 O O27 1 0.34762900 0.52864200 0.05853600 1.0 O O28 1 0.88586100 0.70740900 0.78861200 1.0 O O29 1 0.70740900 0.88586100 0.28861200 1.0 O O30 1 0.11413900 0.29259100 0.21138800 1.0 O O31 1 0.29259100 0.11413900 0.71138800 1.0 O O32 1 0.21766000 0.95822600 0.26619700 1.0 O O33 1 0.95822600 0.21766000 0.76619700 1.0 O O34 1 0.78234000 0.04177400 0.73380300 1.0 O O35 1 0.04177400 0.78234000 0.23380300 1.0 O O36 1 0.02857500 0.84033600 0.59375300 1.0 O O37 1 0.84033600 0.02857500 0.09375300 1.0 O O38 1 0.97142500 0.15966400 0.40624700 1.0 O O39 1 0.15966400 0.97142500 0.90624700 1.0 O O40 1 0.61251700 0.78344400 0.24947100 1.0 O O41 1 0.78344400 0.61251700 0.74947100 1.0 O O42 1 0.38748300 0.21655600 0.75052900 1.0 O O43 1 0.21655600 0.38748300 0.25052900 1.0 O O44 1 0.83178800 0.29705700 0.07740100 1.0 O O45 1 0.29705700 0.83178800 0.57740100 1.0 O O46 1 0.16821200 0.70294300 0.92259900 1.0 O O47 1 0.70294300 0.16821200 0.42259900 1.0 O O48 1 0.48108700 0.91492300 0.48302300 1.0 O O49 1 0.91492300 0.48108700 0.98302300 1.0 O O50 1 0.51891300 0.08507700 0.51697700 1.0 O O51 1 0.08507700 0.51891300 0.01697700 1.0 O O52 1 0.80849300 0.42823100 0.13923600 1.0 O O53 1 0.42823100 0.80849300 0.63923600 1.0 O O54 1 0.19150700 0.57176900 0.86076400 1.0 O O55 1 0.57176900 0.19150700 0.36076400 1.0 O O56 1 0.18757500 0.09101900 0.07228800 1.0 O O57 1 0.09101900 0.18757500 0.57228800 1.0 O O58 1 0.81242500 0.90898100 0.92771200 1.0 O O59 1 0.90898100 0.81242500 0.42771200 1.0 O O60 1 0.24158300 0.75841700 0.25000000 1.0 O O61 1 0.75841700 0.24158300 0.75000000 1.0