# generated using pymatgen data_Tm5Cd3Ni2Hg _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.47870225 _cell_length_b 7.74339863 _cell_length_c 17.76657477 _cell_angle_alpha 90.37886758 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm5Cd3Ni2Hg _chemical_formula_sum 'Tm10 Cd6 Ni4 Hg2' _cell_volume 478.56737543 _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 Tm Tm0 1 0.00000000 0.50000000 0.50000000 1.0 Tm Tm1 1 0.00000000 0.00000000 0.00000000 1.0 Tm Tm2 1 0.00000000 0.75088816 0.27871300 1.0 Tm Tm3 1 0.00000000 0.24911184 0.72128700 1.0 Tm Tm4 1 0.00000000 0.75035764 0.78162791 1.0 Tm Tm5 1 0.00000000 0.24964236 0.21837209 1.0 Tm Tm6 1 0.00000000 0.60898481 0.08807679 1.0 Tm Tm7 1 0.00000000 0.39101519 0.91192321 1.0 Tm Tm8 1 0.00000000 0.88460548 0.58971217 1.0 Tm Tm9 1 0.00000000 0.11539452 0.41028783 1.0 Cd Cd10 1 0.50000000 0.79140105 0.43094744 1.0 Cd Cd11 1 0.50000000 0.20859895 0.56905256 1.0 Cd Cd12 1 0.50000000 0.56851410 0.65166331 1.0 Cd Cd13 1 0.50000000 0.43148590 0.34833669 1.0 Cd Cd14 1 0.50000000 0.92687442 0.15117709 1.0 Cd Cd15 1 0.50000000 0.07312558 0.84882291 1.0 Ni Ni16 1 0.50000000 0.53204842 0.19677091 1.0 Ni Ni17 1 0.50000000 0.46795158 0.80322909 1.0 Ni Ni18 1 0.50000000 0.96825951 0.69737357 1.0 Ni Ni19 1 0.50000000 0.03174049 0.30262643 1.0 Hg Hg20 1 0.50000000 0.71291483 0.93226221 1.0 Hg Hg21 1 0.50000000 0.28708517 0.06773779 1.0