# generated using pymatgen data_Tb4SiCl6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.94777338 _cell_length_b 12.76659007 _cell_length_c 13.52576019 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb4SiCl6 _chemical_formula_sum 'Tb8 Si2 Cl12' _cell_volume 681.69296239 _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 Tb Tb0 1 0.50000000 0.12095338 0.33683687 1.0 Tb Tb1 1 0.50000000 0.87904662 0.66316313 1.0 Tb Tb2 1 0.50000000 0.62095338 0.16316313 1.0 Tb Tb3 1 0.50000000 0.37904662 0.83683687 1.0 Tb Tb4 1 0.00000000 0.12366786 0.58168491 1.0 Tb Tb5 1 0.00000000 0.87633214 0.41831509 1.0 Tb Tb6 1 0.00000000 0.62366786 0.91831509 1.0 Tb Tb7 1 0.00000000 0.37633214 0.08168491 1.0 Si Si8 1 0.50000000 0.00000000 0.50000000 1.0 Si Si9 1 0.50000000 0.50000000 0.00000000 1.0 Cl Cl10 1 0.50000000 0.24577863 0.16544285 1.0 Cl Cl11 1 0.50000000 0.75422137 0.83455715 1.0 Cl Cl12 1 0.50000000 0.74577863 0.33455715 1.0 Cl Cl13 1 0.50000000 0.25422137 0.66544285 1.0 Cl Cl14 1 0.00000000 0.25073973 0.40775889 1.0 Cl Cl15 1 0.00000000 0.74926027 0.59224111 1.0 Cl Cl16 1 0.00000000 0.75073973 0.09224111 1.0 Cl Cl17 1 0.00000000 0.24926027 0.90775889 1.0 Cl Cl18 1 0.00000000 0.00549273 0.24639029 1.0 Cl Cl19 1 0.00000000 0.99450727 0.75360971 1.0 Cl Cl20 1 0.00000000 0.50549273 0.25360971 1.0 Cl Cl21 1 0.00000000 0.49450727 0.74639029 1.0