# generated using pymatgen data_PrTh(TcB2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.31206984 _cell_length_b 6.31207014 _cell_length_c 7.64326607 _cell_angle_alpha 89.28282661 _cell_angle_beta 89.28282176 _cell_angle_gamma 114.90436400 _symmetry_Int_Tables_number 1 _chemical_formula_structural PrTh(TcB2)3 _chemical_formula_sum 'Pr2 Th2 Tc6 B12' _cell_volume 276.13282005 _cell_formula_units_Z 2 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 Pr Pr0 1 0.09261624 0.43752518 0.67703844 1.0 Pr Pr1 1 0.56247482 0.90738376 0.82296156 1.0 Th Th2 1 0.90741461 0.56156387 0.32820742 1.0 Th Th3 1 0.43843613 0.09258539 0.17179258 1.0 Tc Tc4 1 0.41432336 0.58567664 0.25000000 1.0 Tc Tc5 1 0.58424474 0.41575526 0.75000000 1.0 Tc Tc6 1 0.01161792 0.19679889 0.08951471 1.0 Tc Tc7 1 0.80320111 0.98838208 0.41048529 1.0 Tc Tc8 1 0.99011218 0.80391766 0.91375670 1.0 Tc Tc9 1 0.19608234 0.00988782 0.58624330 1.0 B B10 1 0.75709308 0.84956057 0.13007263 1.0 B B11 1 0.15043943 0.24290692 0.36992737 1.0 B B12 1 0.24195384 0.15097666 0.86675048 1.0 B B13 1 0.84902334 0.75804616 0.63324952 1.0 B B14 1 0.41784515 0.84153530 0.48038338 1.0 B B15 1 0.15846470 0.58215485 0.01961662 1.0 B B16 1 0.58061787 0.15931343 0.51651644 1.0 B B17 1 0.84068657 0.41938213 0.98348356 1.0 B B18 1 0.55941000 0.64989825 0.53174593 1.0 B B19 1 0.35010175 0.44059000 0.96825407 1.0 B B20 1 0.44297968 0.34913586 0.46751900 1.0 B B21 1 0.65086414 0.55702032 0.03248100 1.0