# generated using pymatgen data_Ca8PrNd11Sn16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.03746224 _cell_length_b 8.51385793 _cell_length_c 16.13686996 _cell_angle_alpha 90.04735963 _cell_angle_beta 90.48433427 _cell_angle_gamma 90.13344664 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca8PrNd11Sn16 _chemical_formula_sum 'Ca8 Pr1 Nd11 Sn16' _cell_volume 1104.20012826 _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 0.32599753 0.82953430 0.12284651 1.0 Ca Ca1 1 0.16989488 0.32766031 0.62273818 1.0 Ca Ca2 1 0.50851305 0.68339328 0.90586469 1.0 Ca Ca3 1 0.82795003 0.67207963 0.12212824 1.0 Ca Ca4 1 0.16058155 0.49805492 0.24860443 1.0 Ca Ca5 1 0.65958333 0.00143224 0.24829046 1.0 Ca Ca6 1 0.34137198 0.99464705 0.74916841 1.0 Ca Ca7 1 0.83812674 0.50668478 0.74939805 1.0 Pr Pr8 1 0.98848459 0.18608853 0.40402063 1.0 Nd Nd9 1 0.17153179 0.32790096 0.87591385 1.0 Nd Nd10 1 0.50971457 0.68185857 0.59409124 1.0 Nd Nd11 1 0.66894924 0.17541609 0.62447817 1.0 Nd Nd12 1 0.83322065 0.67633845 0.37604524 1.0 Nd Nd13 1 0.98479641 0.18761637 0.09758016 1.0 Nd Nd14 1 0.01444594 0.81178214 0.90225114 1.0 Nd Nd15 1 0.67170150 0.17172434 0.87719679 1.0 Nd Nd16 1 0.48575400 0.31192669 0.09835996 1.0 Nd Nd17 1 0.33256182 0.82379206 0.37560723 1.0 Nd Nd18 1 0.01500056 0.81277689 0.59746243 1.0 Nd Nd19 1 0.48900146 0.31737558 0.40372794 1.0 Sn Sn20 1 0.82538245 0.46387821 0.53616220 1.0 Sn Sn21 1 0.67226330 0.96449819 0.46280219 1.0 Sn Sn22 1 0.71527473 0.86474196 0.74909934 1.0 Sn Sn23 1 0.17291952 0.53626615 0.46264864 1.0 Sn Sn24 1 0.33099651 0.03732018 0.96213142 1.0 Sn Sn25 1 0.78327257 0.36107218 0.25073535 1.0 Sn Sn26 1 0.83554522 0.46668672 0.96055107 1.0 Sn Sn27 1 0.53106461 0.60602701 0.24930483 1.0 Sn Sn28 1 0.16644676 0.53146758 0.03999657 1.0 Sn Sn29 1 0.46957124 0.38970348 0.75041103 1.0 Sn Sn30 1 0.21507959 0.63975303 0.74909147 1.0 Sn Sn31 1 0.97173131 0.09980911 0.75045861 1.0 Sn Sn32 1 0.32977956 0.03322366 0.53767502 1.0 Sn Sn33 1 0.66730531 0.97079004 0.04131460 1.0 Sn Sn34 1 0.28575286 0.13964891 0.25133967 1.0 Sn Sn35 1 0.03043183 0.89703241 0.25050429 1.0