# generated using pymatgen data_Ho5Mg(P2Ru3)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.52521974 _cell_length_b 12.35998263 _cell_length_c 3.96112851 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.56455149 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho5Mg(P2Ru3)6 _chemical_formula_sum 'Ho5 Mg1 P12 Ru18' _cell_volume 533.38614542 _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 Ho Ho0 1 0.00000000 0.18037627 0.50000000 1.0 Ho Ho1 1 0.81730588 0.81780679 0.50000000 1.0 Ho Ho2 1 0.18269412 0.00050091 0.50000000 1.0 Ho Ho3 1 0.65947590 0.32848247 0.00000000 1.0 Ho Ho4 1 0.34052410 0.66900757 0.00000000 1.0 Mg Mg5 1 1.00000000 0.56137611 0.00000000 1.0 P P6 1 0.00000000 0.81038910 0.00000000 1.0 P P7 1 0.18198985 0.18381889 0.00000000 1.0 P P8 1 0.81801015 0.00182903 0.00000000 1.0 P P9 1 0.69102428 0.17226211 0.50000000 1.0 P P10 1 0.81805352 0.51823477 0.50000000 1.0 P P11 1 0.47372302 0.30678551 0.50000000 1.0 P P12 1 0.18194648 0.70018125 0.50000000 1.0 P P13 1 0.52627698 0.83306149 0.50000000 1.0 P P14 1 0.30897572 0.48123783 0.50000000 1.0 P P15 1 0.00000000 0.35986870 0.00000000 1.0 P P16 1 0.62574808 0.62548450 0.00000000 1.0 P P17 1 0.37425192 0.99973641 0.00000000 1.0 Ru Ru18 1 0.44424727 0.44501834 0.00000000 1.0 Ru Ru19 1 0.55575273 0.00077107 0.00000000 1.0 Ru Ru20 1 0.00000000 0.71493253 0.50000000 1.0 Ru Ru21 1 0.28082131 0.28338461 0.50000000 1.0 Ru Ru22 1 0.71917869 0.00256330 0.50000000 1.0 Ru Ru23 1 0.80502881 0.18509651 0.00000000 1.0 Ru Ru24 1 0.81302527 0.61940227 0.00000000 1.0 Ru Ru25 1 0.37202183 0.18834970 0.00000000 1.0 Ru Ru26 1 0.18697473 0.80637699 0.00000000 1.0 Ru Ru27 1 0.62797817 0.81632788 0.00000000 1.0 Ru Ru28 1 0.19497119 0.38006770 0.00000000 1.0 Ru Ru29 1 0.87512062 0.36597339 0.50000000 1.0 Ru Ru30 1 0.63045926 0.50909174 0.50000000 1.0 Ru Ru31 1 0.49259714 0.12923314 0.50000000 1.0 Ru Ru32 1 0.36954074 0.87863248 0.50000000 1.0 Ru Ru33 1 0.50740286 0.63663699 0.50000000 1.0 Ru Ru34 1 0.12487938 0.49085277 0.50000000 1.0 Ru Ru35 1 0.00000000 0.99684886 0.00000000 1.0