# generated using pymatgen data_MgCo4(AsS)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.83814062 _cell_length_b 5.83753715 _cell_length_c 5.84006577 _cell_angle_alpha 91.22265639 _cell_angle_beta 88.97692220 _cell_angle_gamma 91.05021589 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgCo4(AsS)4 _chemical_formula_sum 'Mg1 Co4 As4 S4' _cell_volume 198.92245283 _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 Mg Mg0 1 0.20705800 0.29235700 0.70177800 1.0 Co Co1 1 0.52127900 0.49359800 0.98450500 1.0 Co Co2 1 0.48608200 0.97781800 0.50560600 1.0 Co Co3 1 0.00689200 0.01399300 0.02073600 1.0 Co Co4 1 0.97440500 0.52616400 0.47385400 1.0 As As5 1 0.64267700 0.85799500 0.14094700 1.0 As As6 1 0.11033500 0.65840200 0.88776200 1.0 As As7 1 0.38935800 0.39125600 0.33844800 1.0 As As8 1 0.83939100 0.11137600 0.61044200 1.0 S S9 1 0.41700300 0.08184300 0.92043700 1.0 S S10 1 0.88864300 0.39116800 0.10975300 1.0 S S11 1 0.10868600 0.88981200 0.38816500 1.0 S S12 1 0.61057300 0.61183900 0.60804300 1.0