# generated using pymatgen data_Sm2TcP4Rh5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.95257907 _cell_length_b 11.16200750 _cell_length_c 12.71836101 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm2TcP4Rh5 _chemical_formula_sum 'Sm6 Tc3 P12 Rh15' _cell_volume 561.11777285 _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 Sm Sm0 1 0.00000000 0.50000000 0.52074967 1.0 Sm Sm1 1 0.50000000 0.00000000 0.47870484 1.0 Sm Sm2 1 0.50000000 0.81497915 0.20357992 1.0 Sm Sm3 1 0.50000000 0.18502085 0.20357992 1.0 Sm Sm4 1 0.00000000 0.68218598 0.79662783 1.0 Sm Sm5 1 0.00000000 0.31781402 0.79662783 1.0 Tc Tc6 1 0.50000000 0.50000000 0.15744149 1.0 Tc Tc7 1 0.00000000 0.00000000 0.84141559 1.0 Tc Tc8 1 0.00000000 0.50000000 0.98886617 1.0 P P9 1 0.50000000 0.50000000 0.88029155 1.0 P P10 1 0.00000000 0.00000000 0.12257794 1.0 P P11 1 0.50000000 0.50000000 0.34010987 1.0 P P12 1 0.00000000 0.00000000 0.65762755 1.0 P P13 1 0.50000000 0.31165568 0.61778740 1.0 P P14 1 0.50000000 0.68834432 0.61778740 1.0 P P15 1 0.00000000 0.18739219 0.38230217 1.0 P P16 1 0.00000000 0.81260781 0.38230217 1.0 P P17 1 0.50000000 0.84866357 0.89103935 1.0 P P18 1 0.50000000 0.15133643 0.89103935 1.0 P P19 1 0.00000000 0.64962985 0.10725818 1.0 P P20 1 0.00000000 0.35037015 0.10725818 1.0 Rh Rh21 1 0.50000000 0.50000000 0.69648274 1.0 Rh Rh22 1 0.00000000 0.00000000 0.30156885 1.0 Rh Rh23 1 0.50000000 0.00000000 0.01093603 1.0 Rh Rh24 1 0.50000000 0.32836514 0.98611020 1.0 Rh Rh25 1 0.50000000 0.67163486 0.98611020 1.0 Rh Rh26 1 0.00000000 0.16639174 0.01443747 1.0 Rh Rh27 1 0.00000000 0.83360826 0.01443747 1.0 Rh Rh28 1 0.50000000 0.29377577 0.43146110 1.0 Rh Rh29 1 0.50000000 0.70622423 0.43146110 1.0 Rh Rh30 1 0.00000000 0.20628910 0.57013861 1.0 Rh Rh31 1 0.00000000 0.79371090 0.57013861 1.0 Rh Rh32 1 0.50000000 0.87694041 0.71100737 1.0 Rh Rh33 1 0.50000000 0.12305959 0.71100737 1.0 Rh Rh34 1 0.00000000 0.62384872 0.28986525 1.0 Rh Rh35 1 0.00000000 0.37615128 0.28986525 1.0