# generated using pymatgen data_Th2CoNi7B2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.01234584 _cell_length_b 5.01234548 _cell_length_c 7.01413262 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.42295987 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th2CoNi7B2 _chemical_formula_sum 'Th2 Co1 Ni7 B2' _cell_volume 151.95669317 _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 Th Th0 1 0.00000000 0.00000000 0.50149495 1.0 Th Th1 1 0.00000000 0.00000000 0.99642119 1.0 Co Co2 1 0.50000000 0.50000000 0.70250409 1.0 Ni Ni3 1 0.33584027 0.66415973 0.00007771 1.0 Ni Ni4 1 0.66415973 0.33584027 0.00007771 1.0 Ni Ni5 1 0.50000000 0.00000000 0.29062392 1.0 Ni Ni6 1 0.50000000 0.50000000 0.29175189 1.0 Ni Ni7 1 0.00000000 0.50000000 0.29062392 1.0 Ni Ni8 1 0.50000000 0.00000000 0.71122944 1.0 Ni Ni9 1 0.00000000 0.50000000 0.71122944 1.0 B B10 1 0.66602881 0.33397119 0.50198236 1.0 B B11 1 0.33397119 0.66602881 0.50198236 1.0