# generated using pymatgen data_MgFe4(SbS)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.05746542 _cell_length_b 6.25939856 _cell_length_c 6.33709787 _cell_angle_alpha 110.50707761 _cell_angle_beta 90.06437685 _cell_angle_gamma 91.30010070 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgFe4(SbS)4 _chemical_formula_sum 'Mg1 Fe4 Sb4 S4' _cell_volume 224.98280606 _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 0.00000000 0.00000000 0.50000000 1.0 Fe Fe1 1 0.98527900 0.70456800 0.70397000 1.0 Fe Fe2 1 0.51914000 0.69338500 0.19357400 1.0 Fe Fe3 1 0.01472100 0.29543200 0.29603000 1.0 Fe Fe4 1 0.48086000 0.30661500 0.80642500 1.0 Sb Sb5 1 0.39491500 0.84388500 0.62845800 1.0 Sb Sb6 1 0.60508500 0.15611500 0.37154200 1.0 Sb Sb7 1 0.16301900 0.84510700 0.08590500 1.0 Sb Sb8 1 0.83698100 0.15489300 0.91409500 1.0 S S9 1 0.35125500 0.36566400 0.16146000 1.0 S S10 1 0.64874500 0.63433600 0.83854000 1.0 S S11 1 0.85521400 0.61946400 0.32575700 1.0 S S12 1 0.14478600 0.38053600 0.67424300 1.0