# generated using pymatgen data_TbTh7(Si3Ni)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.99148011 _cell_length_b 7.99146572 _cell_length_c 8.56355771 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00025613 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbTh7(Si3Ni)4 _chemical_formula_sum 'Tb1 Th7 Si12 Ni4' _cell_volume 473.62803730 _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 Tb Tb0 1 0.00000100 0.00000000 0.75000000 1.0 Th Th1 1 0.50003452 0.00007104 0.25000000 1.0 Th Th2 1 0.49997103 0.99994307 0.75000000 1.0 Th Th3 1 0.99992796 0.49996348 0.25000000 1.0 Th Th4 1 0.00005593 0.50002797 0.75000000 1.0 Th Th5 1 0.50003652 0.49996448 0.25000000 1.0 Th Th6 1 0.49997303 0.50002797 0.75000000 1.0 Th Th7 1 0.00000100 0.00000200 0.25000000 1.0 Si Si8 1 0.17082538 0.34165076 0.99818291 1.0 Si Si9 1 0.82918088 0.65836176 0.99807100 1.0 Si Si10 1 0.65835024 0.82917462 0.99818291 1.0 Si Si11 1 0.82918088 0.65836176 0.50192900 1.0 Si Si12 1 0.34163824 0.17081912 0.99807100 1.0 Si Si13 1 0.17082538 0.34165076 0.50181709 1.0 Si Si14 1 0.17082438 0.82917462 0.99818291 1.0 Si Si15 1 0.34163824 0.17081912 0.50192900 1.0 Si Si16 1 0.82918088 0.17081912 0.99807100 1.0 Si Si17 1 0.65835024 0.82917462 0.50181709 1.0 Si Si18 1 0.82918088 0.17081912 0.50192900 1.0 Si Si19 1 0.17082438 0.82917462 0.50181709 1.0 Ni Ni20 1 0.33333400 0.66666800 0.00061307 1.0 Ni Ni21 1 0.66666600 0.33333100 0.00008397 1.0 Ni Ni22 1 0.66666600 0.33333100 0.49991603 1.0 Ni Ni23 1 0.33333400 0.66666800 0.49938693 1.0