# generated using pymatgen data_CaPr2(ErSn2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.98617202 _cell_length_b 8.33297410 _cell_length_c 15.75001298 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaPr2(ErSn2)2 _chemical_formula_sum 'Ca4 Pr8 Er8 Sn16' _cell_volume 1048.14075649 _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 0.17401327 0.49769426 0.75000000 1.0 Ca Ca1 1 0.67401327 0.00230574 0.75000000 1.0 Ca Ca2 1 0.82598673 0.50230574 0.25000000 1.0 Ca Ca3 1 0.32598673 0.99769426 0.25000000 1.0 Pr Pr4 1 0.49808010 0.32072255 0.90386874 1.0 Pr Pr5 1 0.99808010 0.17927745 0.59613126 1.0 Pr Pr6 1 0.50191990 0.67927745 0.40386874 1.0 Pr Pr7 1 0.00191990 0.82072255 0.09613126 1.0 Pr Pr8 1 0.50191990 0.67927745 0.09613126 1.0 Pr Pr9 1 0.00191990 0.82072255 0.40386874 1.0 Pr Pr10 1 0.49808010 0.32072255 0.59613126 1.0 Pr Pr11 1 0.99808010 0.17927745 0.90386874 1.0 Er Er12 1 0.34170702 0.82803047 0.87627647 1.0 Er Er13 1 0.84170702 0.67196953 0.62372353 1.0 Er Er14 1 0.65829298 0.17196953 0.37627647 1.0 Er Er15 1 0.15829298 0.32803047 0.12372353 1.0 Er Er16 1 0.65829298 0.17196953 0.12372353 1.0 Er Er17 1 0.15829298 0.32803047 0.37627647 1.0 Er Er18 1 0.34170702 0.82803047 0.62372353 1.0 Er Er19 1 0.84170702 0.67196953 0.87627647 1.0 Sn Sn20 1 0.32118717 0.04121814 0.03669266 1.0 Sn Sn21 1 0.82118717 0.45878186 0.46330734 1.0 Sn Sn22 1 0.67881283 0.95878186 0.53669266 1.0 Sn Sn23 1 0.17881283 0.54121814 0.96330734 1.0 Sn Sn24 1 0.67881283 0.95878186 0.96330734 1.0 Sn Sn25 1 0.17881283 0.54121814 0.53669266 1.0 Sn Sn26 1 0.32118717 0.04121814 0.46330734 1.0 Sn Sn27 1 0.82118717 0.45878186 0.03669266 1.0 Sn Sn28 1 0.54307242 0.62119963 0.75000000 1.0 Sn Sn29 1 0.04307242 0.87880037 0.75000000 1.0 Sn Sn30 1 0.45692758 0.37880037 0.25000000 1.0 Sn Sn31 1 0.95692758 0.12119963 0.25000000 1.0 Sn Sn32 1 0.30042332 0.13280815 0.75000000 1.0 Sn Sn33 1 0.80042332 0.36719185 0.75000000 1.0 Sn Sn34 1 0.69957668 0.86719185 0.25000000 1.0 Sn Sn35 1 0.19957668 0.63280815 0.25000000 1.0