# generated using pymatgen data_TmZr3(CoB4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.25072603 _cell_length_b 5.79022439 _cell_length_c 11.23999410 _cell_angle_alpha 90.05086299 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmZr3(CoB4)4 _chemical_formula_sum 'Tm1 Zr3 Co4 B16' _cell_volume 211.56395424 _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 Tm Tm0 1 0.50000000 0.87078430 0.34975463 1.0 Zr Zr1 1 0.50000000 0.37350840 0.14921923 1.0 Zr Zr2 1 0.50000000 0.62791648 0.84916789 1.0 Zr Zr3 1 0.50000000 0.12857264 0.65170071 1.0 Co Co4 1 0.50000000 0.36296967 0.41179735 1.0 Co Co5 1 0.50000000 0.63469052 0.59143373 1.0 Co Co6 1 0.50000000 0.13774521 0.90993617 1.0 Co Co7 1 0.50000000 0.86380089 0.08735059 1.0 B B8 1 0.00000000 0.11437877 0.04642630 1.0 B B9 1 0.00000000 0.88636942 0.95264898 1.0 B B10 1 0.00000000 0.38601024 0.54776529 1.0 B B11 1 0.00000000 0.61129724 0.45411376 1.0 B B12 1 0.00000000 0.13560032 0.46845623 1.0 B B13 1 0.00000000 0.86482846 0.53363618 1.0 B B14 1 0.00000000 0.36647113 0.96613715 1.0 B B15 1 0.00000000 0.63343935 0.03282506 1.0 B B16 1 0.00000000 0.02445027 0.19090966 1.0 B B17 1 0.00000000 0.97538654 0.80733185 1.0 B B18 1 0.00000000 0.47635420 0.69353877 1.0 B B19 1 0.00000000 0.52193123 0.30753725 1.0 B B20 1 0.00000000 0.21499400 0.31312166 1.0 B B21 1 0.00000000 0.78806080 0.68704289 1.0 B B22 1 0.00000000 0.28850447 0.81331369 1.0 B B23 1 0.00000000 0.71193343 0.18483697 1.0