# generated using pymatgen data_Tb6Cr3RuC12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.19932837 _cell_length_b 8.19932916 _cell_length_c 5.00492998 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999065 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb6Cr3RuC12 _chemical_formula_sum 'Tb6 Cr3 Ru1 C12' _cell_volume 291.39713657 _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 0.62449477 0.68587933 0.75000000 1.0 Tb Tb1 1 0.93323808 0.62176943 0.25000000 1.0 Tb Tb2 1 0.68853035 0.06676192 0.25000000 1.0 Tb Tb3 1 0.31412067 0.93861445 0.75000000 1.0 Tb Tb4 1 0.06138555 0.37550523 0.75000000 1.0 Tb Tb5 1 0.37823057 0.31146965 0.25000000 1.0 Cr Cr6 1 0.00000000 0.00000000 0.50163939 1.0 Cr Cr7 1 0.00000000 0.00000000 0.99836061 1.0 Cr Cr8 1 0.66666700 0.33333300 0.75000000 1.0 Ru Ru9 1 0.33333300 0.66666700 0.25000000 1.0 C C10 1 0.96228676 0.77288384 0.75000000 1.0 C C11 1 0.18787778 0.96255320 0.25000000 1.0 C C12 1 0.77467642 0.81212222 0.25000000 1.0 C C13 1 0.22711616 0.18940392 0.75000000 1.0 C C14 1 0.81059608 0.03771324 0.75000000 1.0 C C15 1 0.03744680 0.22532358 0.25000000 1.0 C C16 1 0.86083816 0.57813737 0.75000000 1.0 C C17 1 0.29063424 0.87673320 0.25000000 1.0 C C18 1 0.58609795 0.70936576 0.25000000 1.0 C C19 1 0.42186263 0.28270079 0.75000000 1.0 C C20 1 0.12326680 0.41390205 0.25000000 1.0 C C21 1 0.71729921 0.13916184 0.75000000 1.0