# generated using pymatgen data_Cs(CrS2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.96831226 _cell_length_b 6.89201463 _cell_length_c 16.72845945 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cs(CrS2)2 _chemical_formula_sum 'Cs4 Cr8 S16' _cell_volume 688.10335573 _cell_formula_units_Z 4 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 Cs Cs0 1 0.36317119 0.00000000 0.00000000 1.0 Cs Cs1 1 0.63682881 0.50000000 0.50000000 1.0 Cs Cs2 1 0.03255618 0.00000000 0.50000000 1.0 Cs Cs3 1 0.96744382 0.50000000 0.00000000 1.0 Cr Cr4 1 0.00592671 0.00000000 0.25072396 1.0 Cr Cr5 1 0.00592671 0.00000000 0.74927604 1.0 Cr Cr6 1 -0.00592671 0.50000000 0.24927604 1.0 Cr Cr7 1 -0.00592671 0.50000000 0.75072396 1.0 Cr Cr8 1 0.50000000 0.25000000 0.25000000 1.0 Cr Cr9 1 0.50000000 0.75000000 0.75000000 1.0 Cr Cr10 1 0.50000000 0.75000000 0.25000000 1.0 Cr Cr11 1 0.50000000 0.25000000 0.75000000 1.0 S S12 1 0.83426229 0.24962795 0.32969175 1.0 S S13 1 0.83426229 0.75037205 0.67030825 1.0 S S14 1 0.16573771 0.74962795 0.17030825 1.0 S S15 1 0.16573771 0.25037205 0.82969175 1.0 S S16 1 0.16573771 0.25037205 0.17030825 1.0 S S17 1 0.16573771 0.74962795 0.82969175 1.0 S S18 1 0.83426229 0.75037205 0.32969175 1.0 S S19 1 0.83426229 0.24962795 0.67030825 1.0 S S20 1 0.67274884 0.00000000 0.17116218 1.0 S S21 1 0.67274884 0.00000000 0.82883782 1.0 S S22 1 0.32725116 0.50000000 0.32883782 1.0 S S23 1 0.32725116 0.50000000 0.67116218 1.0 S S24 1 0.34010926 0.00000000 0.32994765 1.0 S S25 1 0.34010926 0.00000000 0.67005235 1.0 S S26 1 0.65989074 0.50000000 0.17005235 1.0 S S27 1 0.65989074 0.50000000 0.82994765 1.0