# generated using pymatgen data_Ca2Ti3As7Rh9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.00198484 _cell_length_b 10.00198372 _cell_length_c 3.86172853 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000371 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2Ti3As7Rh9 _chemical_formula_sum 'Ca2 Ti3 As7 Rh9' _cell_volume 334.56822372 _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 0.00000000 0.00000000 0.76381952 1.0 Ca Ca1 1 0.33333300 0.66666700 0.26365084 1.0 Ti Ti2 1 0.78945555 0.55855353 0.76398271 1.0 Ti Ti3 1 0.44144647 0.23090202 0.76398271 1.0 Ti Ti4 1 0.76909798 0.21054445 0.76398271 1.0 As As5 1 0.66666700 0.33333300 0.26400123 1.0 As As6 1 0.08171752 0.62392675 0.76368043 1.0 As As7 1 0.37607325 0.45778877 0.76368043 1.0 As As8 1 0.54221123 0.91828248 0.76368043 1.0 As As9 1 0.24702691 0.03191005 0.26385780 1.0 As As10 1 0.96808995 0.21511686 0.26385780 1.0 As As11 1 0.78488314 0.75297309 0.26385780 1.0 Rh Rh12 1 0.50894150 0.06101528 0.26373100 1.0 Rh Rh13 1 0.93898472 0.44792622 0.26373100 1.0 Rh Rh14 1 0.55207378 0.49105850 0.26373100 1.0 Rh Rh15 1 0.10237751 0.38217786 0.76379779 1.0 Rh Rh16 1 0.61782214 0.72019965 0.76379779 1.0 Rh Rh17 1 0.27980035 0.89762249 0.76379779 1.0 Rh Rh18 1 0.23688743 0.26869547 0.26377242 1.0 Rh Rh19 1 0.73130453 0.96819196 0.26377242 1.0 Rh Rh20 1 0.03180804 0.76311257 0.26377242 1.0