# generated using pymatgen data_Sc3Co2Sn3Ru4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.46357851 _cell_length_b 6.38267431 _cell_length_c 13.34197496 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00023259 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc3Co2Sn3Ru4 _chemical_formula_sum 'Sc6 Co4 Sn6 Ru8' _cell_volume 380.10710164 _cell_formula_units_Z 2 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 Sc Sc0 1 0.99999684 0.00000000 0.00383960 1.0 Sc Sc1 1 0.49994679 0.50000100 0.16281561 1.0 Sc Sc2 1 0.99995332 0.00000000 0.32949968 1.0 Sc Sc3 1 0.50001049 0.50000100 0.49958716 1.0 Sc Sc4 1 0.00005314 0.00000000 0.66707803 1.0 Sc Sc5 1 0.50005832 0.50000100 0.83716043 1.0 Co Co6 1 0.50000190 0.24710637 0.00298726 1.0 Co Co7 1 0.50000190 0.75289363 0.00298726 1.0 Co Co8 1 0.99991403 0.25287387 0.16368514 1.0 Co Co9 1 0.99991403 0.74712613 0.16368514 1.0 Sn Sn10 1 0.00000029 0.50000100 0.00363983 1.0 Sn Sn11 1 0.49995357 0.00000000 0.16301969 1.0 Sn Sn12 1 0.99995716 0.50000100 0.32929829 1.0 Sn Sn13 1 0.50000720 0.00000000 0.49928031 1.0 Sn Sn14 1 0.00005151 0.50000100 0.66739898 1.0 Sn Sn15 1 0.50005295 0.00000000 0.83734165 1.0 Ru Ru16 1 0.49995384 0.25079350 0.32716313 1.0 Ru Ru17 1 0.49995384 0.74920550 0.32716313 1.0 Ru Ru18 1 0.00000651 0.24943152 0.49714868 1.0 Ru Ru19 1 0.00000651 0.75057148 0.49714868 1.0 Ru Ru20 1 0.50004775 0.25058030 0.66954116 1.0 Ru Ru21 1 0.50004775 0.74941870 0.66954116 1.0 Ru Ru22 1 0.00005319 0.24920125 0.83949301 1.0 Ru Ru23 1 0.00005319 0.75079875 0.83949301 1.0