# generated using pymatgen data_Th2CoB10 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.17950791 _cell_length_b 5.61482690 _cell_length_c 11.20433575 _cell_angle_alpha 90.00000429 _cell_angle_beta 89.99999884 _cell_angle_gamma 89.99999860 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th2CoB10 _chemical_formula_sum 'Th4 Co2 B20' _cell_volume 262.93453852 _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 Th Th0 1 0.49999998 0.30137432 0.86574726 1.0 Th Th1 1 0.49999994 0.69862884 0.13430356 1.0 Th Th2 1 0.50000008 0.80137987 0.63422335 1.0 Th Th3 1 0.50000010 0.19862371 0.36572558 1.0 Co Co4 1 -0.00000002 0.49999152 0.49998428 1.0 Co Co5 1 -0.00000011 -0.00000869 1.00001561 1.0 B B6 1 0.00000006 0.12768841 0.53995699 1.0 B B7 1 0.00000001 0.87231309 0.46002690 1.0 B B8 1 -0.00000000 0.62769079 0.96004246 1.0 B B9 1 -0.00000003 0.37231092 0.03997438 1.0 B B10 1 -0.00000000 0.15326803 0.69705842 1.0 B B11 1 0.00000005 0.84673395 0.30293753 1.0 B B12 1 0.29965644 0.20004330 0.11304904 1.0 B B13 1 0.29965748 0.79995881 0.88696241 1.0 B B14 1 0.70034289 0.70004565 0.38695404 1.0 B B15 1 0.70034133 0.29995603 0.61303444 1.0 B B16 1 0.70034238 0.79995886 0.88696243 1.0 B B17 1 0.70034348 0.20004332 0.11304907 1.0 B B18 1 0.29965869 0.29995601 0.61303444 1.0 B B19 1 0.29965713 0.70004565 0.38695405 1.0 B B20 1 0.00000003 0.03420679 0.18701929 1.0 B B21 1 -0.00000000 0.96579127 0.81298875 1.0 B B22 1 0.00000007 0.53421046 0.31298695 1.0 B B23 1 0.00000000 0.46578804 0.68700483 1.0 B B24 1 -0.00000003 0.34673346 0.19706990 1.0 B B25 1 0.00000004 0.65326858 0.80293403 1.0