# generated using pymatgen data_Y3Tm2P12Ru19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.43205681 _cell_length_b 12.43205778 _cell_length_c 3.96163440 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000523 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y3Tm2P12Ru19 _chemical_formula_sum 'Y3 Tm2 P12 Ru19' _cell_volume 530.26261443 _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 Y Y0 1 0.18342811 0.18342811 0.50000000 1.0 Y Y1 1 0.81657189 0.00000000 0.50000000 1.0 Y Y2 1 0.00000000 0.81657189 0.50000000 1.0 Tm Tm3 1 0.33333300 0.66666700 0.00000000 1.0 Tm Tm4 1 0.66666700 0.33333300 0.00000000 1.0 P P5 1 0.81459201 0.81459201 0.00000000 1.0 P P6 1 0.18540799 0.00000000 0.00000000 1.0 P P7 1 0.00000000 0.18540799 0.00000000 1.0 P P8 1 0.17230860 0.47799694 0.50000000 1.0 P P9 1 0.52200306 0.69431166 0.50000000 1.0 P P10 1 0.30568834 0.82769140 0.50000000 1.0 P P11 1 0.69431166 0.52200306 0.50000000 1.0 P P12 1 0.82769140 0.30568834 0.50000000 1.0 P P13 1 0.47799694 0.17230860 0.50000000 1.0 P P14 1 0.37265485 0.37265485 0.00000000 1.0 P P15 1 0.62734515 1.00000000 0.00000000 1.0 P P16 1 1.00000000 0.62734515 0.00000000 1.0 Ru Ru17 1 0.55396489 0.55396489 0.00000000 1.0 Ru Ru18 1 0.44603511 0.00000000 0.00000000 1.0 Ru Ru19 1 0.00000000 0.44603511 0.00000000 1.0 Ru Ru20 1 0.71635621 0.71635621 0.50000000 1.0 Ru Ru21 1 0.28364379 0.00000000 0.50000000 1.0 Ru Ru22 1 0.00000000 0.28364379 0.50000000 1.0 Ru Ru23 1 0.18533727 0.37838907 0.00000000 1.0 Ru Ru24 1 0.62161093 0.80694920 0.00000000 1.0 Ru Ru25 1 0.19305080 0.81466273 0.00000000 1.0 Ru Ru26 1 0.80694920 0.62161093 0.00000000 1.0 Ru Ru27 1 0.81466273 0.19305080 0.00000000 1.0 Ru Ru28 1 0.37838907 0.18533727 0.00000000 1.0 Ru Ru29 1 0.36655973 0.49340963 0.50000000 1.0 Ru Ru30 1 0.50659037 0.87314810 0.50000000 1.0 Ru Ru31 1 0.12685190 0.63344027 0.50000000 1.0 Ru Ru32 1 0.87314810 0.50659037 0.50000000 1.0 Ru Ru33 1 0.63344027 0.12685190 0.50000000 1.0 Ru Ru34 1 0.49340963 0.36655973 0.50000000 1.0 Ru Ru35 1 0.00000000 0.00000000 0.00000000 1.0