# generated using pymatgen data_Sb(SO4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.37954500 _cell_length_b 9.54857400 _cell_length_c 14.13305300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sb(SO4)2 _chemical_formula_sum 'Sb8 S16 O64' _cell_volume 1265.77431019 _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 Sb Sb0 1 0.89797900 0.85869700 0.12523000 1.0 Sb Sb1 1 0.60202100 0.85869700 0.62523000 1.0 Sb Sb2 1 0.39797900 0.64130300 0.12523000 1.0 Sb Sb3 1 0.10202100 0.64130300 0.62523000 1.0 Sb Sb4 1 0.89797900 0.35869700 0.37477000 1.0 Sb Sb5 1 0.60202100 0.35869700 0.87477000 1.0 Sb Sb6 1 0.39797900 0.14130300 0.37477000 1.0 Sb Sb7 1 0.10202100 0.14130300 0.87477000 1.0 S S8 1 0.93228000 0.92620100 0.72434300 1.0 S S9 1 0.56772000 0.92620100 0.22434300 1.0 S S10 1 0.06772000 0.57379900 0.22434300 1.0 S S11 1 0.43228000 0.57379900 0.72434300 1.0 S S12 1 0.56772000 0.42620100 0.27565700 1.0 S S13 1 0.93228000 0.42620100 0.77565700 1.0 S S14 1 0.43228000 0.07379900 0.77565700 1.0 S S15 1 0.06772000 0.07379900 0.27565700 1.0 S S16 1 0.31196900 0.83884500 0.48686600 1.0 S S17 1 0.18803100 0.83884500 0.98686600 1.0 S S18 1 0.81196900 0.66115500 0.48686600 1.0 S S19 1 0.68803100 0.66115500 0.98686600 1.0 S S20 1 0.31196900 0.33884500 0.01313400 1.0 S S21 1 0.18803100 0.33884500 0.51313400 1.0 S S22 1 0.81196900 0.16115500 0.01313400 1.0 S S23 1 0.68803100 0.16115500 0.51313400 1.0 O O24 1 0.30535000 0.99687600 0.47808500 1.0 O O25 1 0.19465000 0.99687600 0.97808500 1.0 O O26 1 0.00721600 0.98688500 0.34758800 1.0 O O27 1 0.49278400 0.98688500 0.84758800 1.0 O O28 1 0.53445900 0.97555400 0.32521900 1.0 O O29 1 0.96554100 0.97555400 0.82521900 1.0 O O30 1 0.77042300 0.91979500 0.72533800 1.0 O O31 1 0.72957700 0.91979500 0.22533800 1.0 O O32 1 0.27016600 0.81314000 0.07883700 1.0 O O33 1 0.22983400 0.81314000 0.57883700 1.0 O O34 1 0.03387500 0.79918100 0.00861800 1.0 O O35 1 0.46612500 0.79918100 0.50861800 1.0 O O36 1 0.98450100 0.77472700 0.72221500 1.0 O O37 1 0.51549900 0.77472700 0.22221500 1.0 O O38 1 0.25928300 0.76300500 0.40716500 1.0 O O39 1 0.24071700 0.76300500 0.90716500 1.0 O O40 1 0.75928300 0.73699500 0.40716500 1.0 O O41 1 0.74071700 0.73699500 0.90716500 1.0 O O42 1 0.01549900 0.72527300 0.22221500 1.0 O O43 1 0.48450100 0.72527300 0.72221500 1.0 O O44 1 0.96612500 0.70081900 0.50861800 1.0 O O45 1 0.53387500 0.70081900 0.00861800 1.0 O O46 1 0.77016600 0.68686000 0.07883700 1.0 O O47 1 0.72983400 0.68686000 0.57883700 1.0 O O48 1 0.22957700 0.58020500 0.22533800 1.0 O O49 1 0.27042300 0.58020500 0.72533800 1.0 O O50 1 0.46554100 0.52444600 0.82521900 1.0 O O51 1 0.03445900 0.52444600 0.32521900 1.0 O O52 1 0.50721600 0.51311500 0.34758800 1.0 O O53 1 0.99278400 0.51311500 0.84758800 1.0 O O54 1 0.80535000 0.50312400 0.47808500 1.0 O O55 1 0.69465000 0.50312400 0.97808500 1.0 O O56 1 0.30535000 0.49687600 0.02191500 1.0 O O57 1 0.19465000 0.49687600 0.52191500 1.0 O O58 1 0.49278400 0.48688500 0.65241200 1.0 O O59 1 0.00721600 0.48688500 0.15241200 1.0 O O60 1 0.53445900 0.47555400 0.17478100 1.0 O O61 1 0.96554100 0.47555400 0.67478100 1.0 O O62 1 0.72957700 0.41979500 0.27466200 1.0 O O63 1 0.77042300 0.41979500 0.77466200 1.0 O O64 1 0.27016600 0.31314000 0.42116300 1.0 O O65 1 0.22983400 0.31314000 0.92116300 1.0 O O66 1 0.46612500 0.29918100 0.99138200 1.0 O O67 1 0.03387500 0.29918100 0.49138200 1.0 O O68 1 0.51549900 0.27472700 0.27778500 1.0 O O69 1 0.98450100 0.27472700 0.77778500 1.0 O O70 1 0.25928300 0.26300500 0.09283500 1.0 O O71 1 0.24071700 0.26300500 0.59283500 1.0 O O72 1 0.75928300 0.23699500 0.09283500 1.0 O O73 1 0.74071700 0.23699500 0.59283500 1.0 O O74 1 0.48450100 0.22527300 0.77778500 1.0 O O75 1 0.01549900 0.22527300 0.27778500 1.0 O O76 1 0.53387500 0.20081900 0.49138200 1.0 O O77 1 0.96612500 0.20081900 0.99138200 1.0 O O78 1 0.77016600 0.18686000 0.42116300 1.0 O O79 1 0.72983400 0.18686000 0.92116300 1.0 O O80 1 0.27042300 0.08020500 0.77466200 1.0 O O81 1 0.22957700 0.08020500 0.27466200 1.0 O O82 1 0.46554100 0.02444600 0.67478100 1.0 O O83 1 0.03445900 0.02444600 0.17478100 1.0 O O84 1 0.99278400 0.01311500 0.65241200 1.0 O O85 1 0.50721600 0.01311500 0.15241200 1.0 O O86 1 0.80535000 0.00312400 0.02191500 1.0 O O87 1 0.69465000 0.00312400 0.52191500 1.0