# generated using pymatgen data_Ho17Sc3(Ir2Os)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.64327648 _cell_length_b 10.64327648 _cell_length_c 6.30915642 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho17Sc3(Ir2Os)4 _chemical_formula_sum 'Ho17 Sc3 Ir8 Os4' _cell_volume 714.69703811 _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 0.28988751 0.08491523 0.37608715 1.0 Ho Ho1 1 0.28974401 0.91546715 0.87657870 1.0 Ho Ho2 1 0.71025599 0.08453285 0.87657870 1.0 Ho Ho3 1 0.71011249 0.91508477 0.37608715 1.0 Ho Ho4 1 0.58496400 0.79139518 0.87549189 1.0 Ho Ho5 1 0.58541372 0.20664588 0.37519035 1.0 Ho Ho6 1 0.41458628 0.79335412 0.37519035 1.0 Ho Ho7 1 0.41503600 0.20860482 0.87549189 1.0 Ho Ho8 1 0.20664588 0.41458628 0.62480965 1.0 Ho Ho9 1 0.20860482 0.58496400 0.12450811 1.0 Ho Ho10 1 0.79139518 0.41503600 0.12450811 1.0 Ho Ho11 1 0.79335412 0.58541372 0.62480965 1.0 Ho Ho12 1 0.91546715 0.71025599 0.12342130 1.0 Ho Ho13 1 0.91508477 0.28988751 0.62391285 1.0 Ho Ho14 1 0.08491523 0.71011249 0.62391285 1.0 Ho Ho15 1 0.08453285 0.28974401 0.12342130 1.0 Ho Ho16 1 0.50000000 0.50000000 0.50000000 1.0 Sc Sc17 1 0.00000000 0.00000000 0.50000000 1.0 Sc Sc18 1 0.00000000 0.00000000 0.00000000 1.0 Sc Sc19 1 0.50000000 0.50000000 0.00000000 1.0 Ir Ir20 1 0.85347158 0.14601925 0.25049471 1.0 Ir Ir21 1 0.85398075 0.85347158 0.74950529 1.0 Ir Ir22 1 0.14601925 0.14652842 0.74950529 1.0 Ir Ir23 1 0.14652842 0.85398075 0.25049471 1.0 Ir Ir24 1 0.64948210 0.34930879 0.75587543 1.0 Ir Ir25 1 0.65069121 0.64948210 0.24412457 1.0 Ir Ir26 1 0.34930879 0.35051790 0.24412457 1.0 Ir Ir27 1 0.35051790 0.65069121 0.75587543 1.0 Os Os28 1 0.50000000 0.00000000 0.12376011 1.0 Os Os29 1 0.50000000 0.00000000 0.62473621 1.0 Os Os30 1 0.00000000 0.50000000 0.87623989 1.0 Os Os31 1 0.00000000 0.50000000 0.37526379 1.0