# generated using pymatgen data_Tm7Th(NiHg)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.37979553 _cell_length_b 9.37979592 _cell_length_c 9.38727851 _cell_angle_alpha 59.97360422 _cell_angle_beta 59.97360282 _cell_angle_gamma 60.20048533 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm7Th(NiHg)2 _chemical_formula_sum 'Tm14 Th2 Ni4 Hg4' _cell_volume 584.64367800 _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 0.35247512 0.93941740 0.35405424 1.0 Tm Tm1 1 0.93941740 0.35247512 0.35405424 1.0 Tm Tm2 1 0.81309495 0.19004538 0.18621032 1.0 Tm Tm3 1 0.19004538 0.81309495 0.81064935 1.0 Tm Tm4 1 0.19004538 0.81309495 0.18621032 1.0 Tm Tm5 1 0.81309495 0.19004538 0.81064935 1.0 Tm Tm6 1 0.18647503 0.18647503 0.81352497 1.0 Tm Tm7 1 0.81078046 0.81078046 0.18921954 1.0 Tm Tm8 1 0.93627537 0.56430327 0.56491095 1.0 Tm Tm9 1 0.56430327 0.93627537 0.93451041 1.0 Tm Tm10 1 0.56430327 0.93627537 0.56491095 1.0 Tm Tm11 1 0.93627537 0.56430327 0.93451041 1.0 Tm Tm12 1 0.56349846 0.56349846 0.93650154 1.0 Tm Tm13 1 0.93774037 0.93774037 0.56225963 1.0 Th Th14 1 0.34629420 0.34629420 0.35398085 1.0 Th Th15 1 0.34629420 0.34629420 0.95343275 1.0 Ni Ni16 1 0.14228665 0.14228665 0.14450879 1.0 Ni Ni17 1 0.14228665 0.14228665 0.57091791 1.0 Ni Ni18 1 0.14518314 0.57122415 0.14179635 1.0 Ni Ni19 1 0.57122415 0.14518314 0.14179635 1.0 Hg Hg20 1 0.58936477 0.58936477 0.58319557 1.0 Hg Hg21 1 0.58936477 0.58936477 0.23807390 1.0 Hg Hg22 1 0.59274478 0.23713290 0.58506116 1.0 Hg Hg23 1 0.23713290 0.59274478 0.58506116 1.0