# generated using pymatgen data_CaTm2(SiRh2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.52161971 _cell_length_b 5.52161879 _cell_length_c 14.80524878 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99998800 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaTm2(SiRh2)3 _chemical_formula_sum 'Ca2 Tm4 Si6 Rh12' _cell_volume 390.91227292 _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 Ca Ca0 1 0.33333300 0.66666700 0.75000000 1.0 Ca Ca1 1 0.66666700 0.33333300 0.25000000 1.0 Tm Tm2 1 0.33333300 0.66666700 0.53939947 1.0 Tm Tm3 1 0.66666700 0.33333300 0.46060053 1.0 Tm Tm4 1 0.66666700 0.33333300 0.03939947 1.0 Tm Tm5 1 0.33333300 0.66666700 0.96060053 1.0 Si Si6 1 0.00000000 0.00000000 0.25000000 1.0 Si Si7 1 0.00000000 0.00000000 0.75000000 1.0 Si Si8 1 0.33333300 0.66666700 0.25000000 1.0 Si Si9 1 0.66666700 0.33333300 0.75000000 1.0 Si Si10 1 0.00000000 0.00000000 0.00000000 1.0 Si Si11 1 0.00000000 0.00000000 0.50000000 1.0 Rh Rh12 1 0.16694397 0.33388995 0.12849171 1.0 Rh Rh13 1 0.83305603 0.66611005 0.87150829 1.0 Rh Rh14 1 0.66611005 0.83305603 0.12849171 1.0 Rh Rh15 1 0.83305603 0.66611005 0.62849171 1.0 Rh Rh16 1 0.33388995 0.16694397 0.87150829 1.0 Rh Rh17 1 0.16694397 0.33388995 0.37150829 1.0 Rh Rh18 1 0.16694397 0.83305603 0.12849171 1.0 Rh Rh19 1 0.33388995 0.16694397 0.62849171 1.0 Rh Rh20 1 0.83305603 0.16694397 0.87150829 1.0 Rh Rh21 1 0.66611005 0.83305603 0.37150829 1.0 Rh Rh22 1 0.83305603 0.16694397 0.62849171 1.0 Rh Rh23 1 0.16694397 0.83305603 0.37150829 1.0