# generated using pymatgen data_Al14(CuS8)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.02787477 _cell_length_b 7.02787477 _cell_length_c 17.35692511 _cell_angle_alpha 89.91914215 _cell_angle_beta 89.91914215 _cell_angle_gamma 60.25845888 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al14(CuS8)3 _chemical_formula_sum 'Al14 Cu3 S24' _cell_volume 744.34807258 _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 0.34058600 0.81896500 0.16503100 1.0 Al Al1 1 0.00571700 0.48919900 0.49919200 1.0 Al Al2 1 0.67396100 0.15182200 0.83088100 1.0 Al Al3 1 0.50000300 0.50000300 0.00613900 1.0 Al Al4 1 0.16437600 0.16437600 0.34033100 1.0 Al Al5 1 0.83607400 0.83607400 0.66785900 1.0 Al Al6 1 0.81896500 0.34058600 0.16503100 1.0 Al Al7 1 0.48919900 0.00571700 0.49919200 1.0 Al Al8 1 0.15182200 0.67396100 0.83088100 1.0 Al Al9 1 0.34047400 0.34047400 0.16497700 1.0 Al Al10 1 0.67418900 0.67418900 0.83079700 1.0 Al Al11 1 0.83131400 0.83131400 0.29454100 1.0 Al Al12 1 0.49403800 0.49403800 0.62369900 1.0 Al Al13 1 0.16642500 0.16642500 0.95862500 1.0 Cu Cu14 1 0.83349400 0.83349400 0.04141000 1.0 Cu Cu15 1 0.50292600 0.50292600 0.37691100 1.0 Cu Cu16 1 0.16649900 0.16649900 0.70573400 1.0 S S17 1 0.65741900 0.65741900 0.08575300 1.0 S S18 1 0.32393200 0.32393200 0.41807200 1.0 S S19 1 0.99150200 0.99150200 0.75330500 1.0 S S20 1 0.18521300 0.65734600 0.08560600 1.0 S S21 1 0.85136200 0.32648700 0.41877200 1.0 S S22 1 0.51916500 0.98930900 0.75240000 1.0 S S23 1 0.49960300 0.49960300 0.24299400 1.0 S S24 1 0.16939700 0.16939700 0.57760500 1.0 S S25 1 0.83334000 0.83334000 0.90981200 1.0 S S26 1 0.65734600 0.18521300 0.08560600 1.0 S S27 1 0.32648700 0.85136200 0.41877200 1.0 S S28 1 0.98930900 0.51916500 0.75240000 1.0 S S29 1 0.01243300 0.47649800 0.24606000 1.0 S S30 1 0.67493200 0.14605300 0.58159900 1.0 S S31 1 0.34437400 0.81114100 0.91435000 1.0 S S32 1 0.16656500 0.16656500 0.09106300 1.0 S S33 1 0.83190000 0.83190000 0.42337100 1.0 S S34 1 0.50047800 0.50047800 0.75978600 1.0 S S35 1 0.47649800 0.01243300 0.24606000 1.0 S S36 1 0.14605300 0.67493200 0.58159900 1.0 S S37 1 0.81114100 0.34437400 0.91435000 1.0 S S38 1 0.01083700 0.01083700 0.24652700 1.0 S S39 1 0.67709300 0.67709300 0.58099600 1.0 S S40 1 0.34447600 0.34447600 0.91418500 1.0