# generated using pymatgen data_CaNdSi7Rh12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.70830595 _cell_length_b 9.70830611 _cell_length_c 3.84498961 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000275 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaNdSi7Rh12 _chemical_formula_sum 'Ca1 Nd1 Si7 Rh12' _cell_volume 313.84318778 _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 Ca Ca0 1 0.33333300 0.66666700 0.25267405 1.0 Nd Nd1 1 0.00000000 0.00000000 0.74989417 1.0 Si Si2 1 0.66666700 0.33333300 0.50682370 1.0 Si Si3 1 0.06583853 0.62337101 0.75242898 1.0 Si Si4 1 0.37662899 0.44246652 0.75242898 1.0 Si Si5 1 0.55753348 0.93416147 0.75242898 1.0 Si Si6 1 0.27062303 0.04242012 0.25090873 1.0 Si Si7 1 0.95757988 0.22820290 0.25090873 1.0 Si Si8 1 0.77179710 0.72937697 0.25090873 1.0 Rh Rh9 1 0.80939229 0.59438821 0.74615251 1.0 Rh Rh10 1 0.40561179 0.21500308 0.74615251 1.0 Rh Rh11 1 0.78499692 0.19060771 0.74615251 1.0 Rh Rh12 1 0.52640591 0.07358188 0.25792950 1.0 Rh Rh13 1 0.92641812 0.45282403 0.25792950 1.0 Rh Rh14 1 0.54717597 0.47359409 0.25792950 1.0 Rh Rh15 1 0.10889167 0.39523659 0.75312355 1.0 Rh Rh16 1 0.60476341 0.71365508 0.75312355 1.0 Rh Rh17 1 0.28634492 0.89110833 0.75312355 1.0 Rh Rh18 1 0.22543540 0.27283347 0.24963875 1.0 Rh Rh19 1 0.72716653 0.95260293 0.24963875 1.0 Rh Rh20 1 0.04739707 0.77456460 0.24963875 1.0