# generated using pymatgen data_ZnFe4Cu10(SnS4)5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.43287900 _cell_length_b 5.43287900 _cell_length_c 27.00224311 _cell_angle_alpha 95.77375064 _cell_angle_beta 95.77375064 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZnFe4Cu10(SnS4)5 _chemical_formula_sum 'Zn1 Fe4 Cu10 Sn5 S20' _cell_volume 788.89564234 _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 Zn Zn0 1 0.40000000 0.40000000 0.80000000 1.0 Fe Fe1 1 0.00001400 0.00001400 0.00002800 1.0 Fe Fe2 1 0.60001700 0.60001700 0.20003400 1.0 Fe Fe3 1 0.19998300 0.19998300 0.39996600 1.0 Fe Fe4 1 0.79998600 0.79998600 0.59997200 1.0 Cu Cu5 1 0.55001300 0.05001300 0.10002500 1.0 Cu Cu6 1 0.15000000 0.65000000 0.30000000 1.0 Cu Cu7 1 0.74998800 0.24998800 0.49997500 1.0 Cu Cu8 1 0.34971500 0.84971500 0.69942900 1.0 Cu Cu9 1 0.95028500 0.45028500 0.90057100 1.0 Cu Cu10 1 0.05001300 0.55001300 0.10002500 1.0 Cu Cu11 1 0.65000000 0.15000000 0.30000000 1.0 Cu Cu12 1 0.24998800 0.74998800 0.49997500 1.0 Cu Cu13 1 0.84971500 0.34971500 0.69942900 1.0 Cu Cu14 1 0.45028500 0.95028500 0.90057100 1.0 Sn Sn15 1 0.50005000 0.50005000 0.00010000 1.0 Sn Sn16 1 0.10001800 0.10001800 0.20003600 1.0 Sn Sn17 1 0.69998200 0.69998200 0.39996400 1.0 Sn Sn18 1 0.29995000 0.29995000 0.59990000 1.0 Sn Sn19 1 0.90000000 0.90000000 0.80000000 1.0 S S20 1 0.80694500 0.80694500 0.14711800 1.0 S S21 1 0.40685600 0.40685600 0.34710200 1.0 S S22 1 0.00709800 0.00709800 0.54713800 1.0 S S23 1 0.61404800 0.61404800 0.74608600 1.0 S S24 1 0.20742400 0.20742400 0.94730900 1.0 S S25 1 0.34017300 0.34017300 0.14711800 1.0 S S26 1 0.94024600 0.94024600 0.34710200 1.0 S S27 1 0.54004000 0.54004000 0.54713800 1.0 S S28 1 0.13203800 0.13203800 0.74608600 1.0 S S29 1 0.73988500 0.73988500 0.94730900 1.0 S S30 1 0.79290200 0.25996000 0.05286200 1.0 S S31 1 0.39314400 0.85975400 0.25289800 1.0 S S32 1 0.99305500 0.45982700 0.45288200 1.0 S S33 1 0.59257600 0.06011500 0.65269100 1.0 S S34 1 0.18595200 0.66796200 0.85391400 1.0 S S35 1 0.25996000 0.79290200 0.05286200 1.0 S S36 1 0.85975400 0.39314400 0.25289800 1.0 S S37 1 0.45982700 0.99305500 0.45288200 1.0 S S38 1 0.06011500 0.59257600 0.65269100 1.0 S S39 1 0.66796200 0.18595200 0.85391400 1.0