# generated using pymatgen data_CaNd15(InRu)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.90995330 _cell_length_b 9.90996252 _cell_length_c 9.92145326 _cell_angle_alpha 59.96151219 _cell_angle_beta 59.96149778 _cell_angle_gamma 59.87444491 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaNd15(InRu)4 _chemical_formula_sum 'Ca1 Nd15 In4 Ru4' _cell_volume 687.91956584 _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 0.44062298 0.44062333 0.05937691 1.0 Nd Nd1 1 0.65305420 0.65305422 0.04041465 1.0 Nd Nd2 1 0.19332403 0.80629276 0.19418902 1.0 Nd Nd3 1 0.06116034 0.43908224 0.05964863 1.0 Nd Nd4 1 0.19332386 0.80629292 0.80619438 1.0 Nd Nd5 1 0.06115999 0.43908251 0.44010903 1.0 Nd Nd6 1 0.80629279 0.19332396 0.19418931 1.0 Nd Nd7 1 0.65305455 0.65305454 0.65347656 1.0 Nd Nd8 1 0.80629254 0.19332392 0.80619437 1.0 Nd Nd9 1 0.19254424 0.19254395 0.80745617 1.0 Nd Nd10 1 0.04067467 0.65282288 0.65325091 1.0 Nd Nd11 1 0.43908197 0.06116038 0.05964823 1.0 Nd Nd12 1 0.06116230 0.06116297 0.43883725 1.0 Nd Nd13 1 0.65282338 0.04067412 0.65325093 1.0 Nd Nd14 1 0.80701526 0.80701543 0.19298444 1.0 Nd Nd15 1 0.43908230 0.06116035 0.44010914 1.0 In In16 1 0.41797472 0.41797505 0.42099673 1.0 In In17 1 0.41797457 0.41797497 0.74305383 1.0 In In18 1 0.42000928 0.74085430 0.41956804 1.0 In In19 1 0.74085443 0.42000947 0.41956790 1.0 Ru Ru20 1 0.40846906 0.86553797 0.86299626 1.0 Ru Ru21 1 0.86425458 0.86425378 0.86367661 1.0 Ru Ru22 1 0.86553862 0.40846906 0.86299652 1.0 Ru Ru23 1 0.86425433 0.86425391 0.40781416 1.0