# generated using pymatgen data_LiTb6P12Rh17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.92102703 _cell_length_b 11.14436385 _cell_length_c 12.65396995 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiTb6P12Rh17 _chemical_formula_sum 'Li1 Tb6 P12 Rh17' _cell_volume 552.94497719 _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 Li Li0 1 0.50000000 0.50000000 0.15530029 1.0 Tb Tb1 1 0.00000000 0.50000000 0.51744596 1.0 Tb Tb2 1 0.50000000 0.00000000 0.47926529 1.0 Tb Tb3 1 0.50000000 0.81695738 0.20576802 1.0 Tb Tb4 1 0.50000000 0.18304262 0.20576802 1.0 Tb Tb5 1 0.00000000 0.68279039 0.79439483 1.0 Tb Tb6 1 0.00000000 0.31720961 0.79439483 1.0 P P7 1 0.50000000 0.50000000 0.88207466 1.0 P P8 1 0.00000000 0.00000000 0.11959954 1.0 P P9 1 0.50000000 0.50000000 0.34483081 1.0 P P10 1 0.00000000 0.00000000 0.64821431 1.0 P P11 1 0.50000000 0.31447142 0.61871628 1.0 P P12 1 0.50000000 0.68552858 0.61871628 1.0 P P13 1 0.00000000 0.18812650 0.38254992 1.0 P P14 1 0.00000000 0.81187350 0.38254992 1.0 P P15 1 0.50000000 0.84517438 0.89215658 1.0 P P16 1 0.50000000 0.15482562 0.89215658 1.0 P P17 1 0.00000000 0.65762816 0.10804817 1.0 P P18 1 0.00000000 0.34237184 0.10804817 1.0 Rh Rh19 1 0.00000000 0.00000000 0.82896119 1.0 Rh Rh20 1 0.50000000 0.50000000 0.70229961 1.0 Rh Rh21 1 0.00000000 0.00000000 0.29912350 1.0 Rh Rh22 1 0.00000000 0.50000000 0.98556037 1.0 Rh Rh23 1 0.50000000 0.00000000 0.01699011 1.0 Rh Rh24 1 0.50000000 0.33143196 0.99397975 1.0 Rh Rh25 1 0.50000000 0.66856804 0.99397975 1.0 Rh Rh26 1 0.00000000 0.16519361 0.00610404 1.0 Rh Rh27 1 0.00000000 0.83480639 0.00610404 1.0 Rh Rh28 1 0.50000000 0.29113170 0.43367384 1.0 Rh Rh29 1 0.50000000 0.70886830 0.43367384 1.0 Rh Rh30 1 0.00000000 0.20283044 0.57202633 1.0 Rh Rh31 1 0.00000000 0.79716956 0.57202633 1.0 Rh Rh32 1 0.50000000 0.87413545 0.71172731 1.0 Rh Rh33 1 0.50000000 0.12586455 0.71172731 1.0 Rh Rh34 1 0.00000000 0.62666322 0.29102063 1.0 Rh Rh35 1 0.00000000 0.37333678 0.29102063 1.0