# generated using pymatgen data_Tm2P4RuRh5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.88712405 _cell_length_b 11.17043566 _cell_length_c 12.47260559 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm2P4RuRh5 _chemical_formula_sum 'Tm6 P12 Ru3 Rh15' _cell_volume 541.57137419 _cell_formula_units_Z 3 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 Tm Tm0 1 0.00000000 0.50000000 0.52314629 1.0 Tm Tm1 1 0.50000000 0.00000000 0.47694191 1.0 Tm Tm2 1 0.50000000 0.82004704 0.20613480 1.0 Tm Tm3 1 0.50000000 0.17995296 0.20613480 1.0 Tm Tm4 1 0.00000000 0.67786873 0.79423610 1.0 Tm Tm5 1 0.00000000 0.32213127 0.79423610 1.0 P P6 1 0.50000000 0.50000000 0.88012372 1.0 P P7 1 0.00000000 0.00000000 0.11739712 1.0 P P8 1 0.50000000 0.50000000 0.35089207 1.0 P P9 1 0.00000000 0.00000000 0.64765033 1.0 P P10 1 0.50000000 0.31557959 0.61924278 1.0 P P11 1 0.50000000 0.68442041 0.61924278 1.0 P P12 1 0.00000000 0.18492813 0.38093511 1.0 P P13 1 0.00000000 0.81507187 0.38093511 1.0 P P14 1 0.50000000 0.84346768 0.89239105 1.0 P P15 1 0.50000000 0.15653232 0.89239105 1.0 P P16 1 0.00000000 0.65377129 0.10903931 1.0 P P17 1 0.00000000 0.34622871 0.10903931 1.0 Ru Ru18 1 0.50000000 0.50000000 0.16367018 1.0 Ru Ru19 1 0.00000000 0.50000000 0.99106444 1.0 Ru Ru20 1 0.50000000 0.00000000 0.00980287 1.0 Rh Rh21 1 0.00000000 0.00000000 0.83469363 1.0 Rh Rh22 1 0.50000000 0.50000000 0.69909764 1.0 Rh Rh23 1 0.00000000 0.00000000 0.29911374 1.0 Rh Rh24 1 0.50000000 0.33239168 0.98941653 1.0 Rh Rh25 1 0.50000000 0.66760832 0.98941653 1.0 Rh Rh26 1 0.00000000 0.16934064 0.01113924 1.0 Rh Rh27 1 0.00000000 0.83065936 0.01113924 1.0 Rh Rh28 1 0.50000000 0.29640440 0.43059145 1.0 Rh Rh29 1 0.50000000 0.70359560 0.43059145 1.0 Rh Rh30 1 0.00000000 0.20056033 0.56889642 1.0 Rh Rh31 1 0.00000000 0.79943967 0.56889642 1.0 Rh Rh32 1 0.50000000 0.87034852 0.71228681 1.0 Rh Rh33 1 0.50000000 0.12965148 0.71228681 1.0 Rh Rh34 1 0.00000000 0.62727284 0.28889244 1.0 Rh Rh35 1 0.00000000 0.37272716 0.28889244 1.0