# generated using pymatgen data_MgCo4(AsS)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.85442099 _cell_length_b 5.85442099 _cell_length_c 5.85442099 _cell_angle_alpha 93.05051388 _cell_angle_beta 93.05051388 _cell_angle_gamma 86.94948612 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgCo4(AsS)4 _chemical_formula_sum 'Mg1 Co4 As4 S4' _cell_volume 199.83202899 _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 0.29382600 0.79382600 0.70617400 1.0 Co Co1 1 0.49279700 0.49410500 0.01227300 1.0 Co Co2 1 0.52051300 0.02051300 0.47948700 1.0 Co Co3 1 0.98772700 0.99279700 0.00589500 1.0 Co Co4 1 0.99410500 0.48772700 0.50720300 1.0 As As5 1 0.62438000 0.88070300 0.11369000 1.0 As As6 1 0.07598100 0.57598100 0.92401900 1.0 As As7 1 0.38070300 0.38631000 0.37562000 1.0 As As8 1 0.88631000 0.12438000 0.61929700 1.0 S S9 1 0.41070200 0.14461900 0.87401100 1.0 S S10 1 0.86393500 0.36393500 0.13606500 1.0 S S11 1 0.12598900 0.91070200 0.35538100 1.0 S S12 1 0.64461900 0.62598900 0.58929800 1.0