# generated using pymatgen data_Ca3SnGeRh2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.77586677 _cell_length_b 8.08341284 _cell_length_c 13.73363003 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca3SnGeRh2 _chemical_formula_sum 'Ca12 Sn4 Ge4 Rh8' _cell_volume 641.20554670 _cell_formula_units_Z 4 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 0.63711559 0.24384559 0.25000000 1.0 Ca Ca1 1 0.36288441 0.75615441 0.75000000 1.0 Ca Ca2 1 0.36288441 0.74384559 0.25000000 1.0 Ca Ca3 1 0.63711559 0.25615441 0.75000000 1.0 Ca Ca4 1 0.14691561 0.39631917 0.09932424 1.0 Ca Ca5 1 0.85308439 0.60368083 0.90067576 1.0 Ca Ca6 1 0.85308439 0.60368083 0.59932424 1.0 Ca Ca7 1 0.85308439 0.89631917 0.40067576 1.0 Ca Ca8 1 0.14691561 0.39631917 0.40067576 1.0 Ca Ca9 1 0.14691561 0.10368083 0.59932424 1.0 Ca Ca10 1 0.14691561 0.10368083 0.90067576 1.0 Ca Ca11 1 0.85308439 0.89631917 0.09932424 1.0 Sn Sn12 1 0.62658698 0.25000000 0.00000000 1.0 Sn Sn13 1 0.37341302 0.75000000 0.00000000 1.0 Sn Sn14 1 0.37341302 0.75000000 0.50000000 1.0 Sn Sn15 1 0.62658698 0.25000000 0.50000000 1.0 Ge Ge16 1 0.15136253 0.09039484 0.25000000 1.0 Ge Ge17 1 0.84863747 0.90960516 0.75000000 1.0 Ge Ge18 1 0.84863747 0.59039484 0.25000000 1.0 Ge Ge19 1 0.15136253 0.40960516 0.75000000 1.0 Rh Rh20 1 0.35657875 0.03403787 0.09679092 1.0 Rh Rh21 1 0.64342125 0.96596213 0.90320908 1.0 Rh Rh22 1 0.64342125 0.96596213 0.59679092 1.0 Rh Rh23 1 0.64342125 0.53403787 0.40320908 1.0 Rh Rh24 1 0.35657875 0.03403787 0.40320908 1.0 Rh Rh25 1 0.35657875 0.46596213 0.59679092 1.0 Rh Rh26 1 0.35657875 0.46596213 0.90320908 1.0 Rh Rh27 1 0.64342125 0.53403787 0.09679092 1.0