# generated using pymatgen data_SrCeI4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.49990849 _cell_length_b 8.68164614 _cell_length_c 9.10762997 _cell_angle_alpha 113.49655936 _cell_angle_beta 108.67544391 _cell_angle_gamma 101.03809621 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrCeI4 _chemical_formula_sum 'Sr2 Ce2 I8' _cell_volume 479.19152165 _cell_formula_units_Z 2 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 Sr Sr0 1 0.38529365 0.13535220 0.27047878 1.0 Sr Sr1 1 0.61470635 0.86464880 0.72952122 1.0 Ce Ce2 1 0.75063319 0.50049742 0.00188354 1.0 Ce Ce3 1 0.24936681 0.49950258 0.99811646 1.0 I I4 1 0.99368717 0.25690893 0.12362458 1.0 I I5 1 0.21206816 0.79991684 0.35432037 1.0 I I6 1 0.64278306 0.55404537 0.35419467 1.0 I I7 1 0.35721694 0.44595463 0.64580533 1.0 I I8 1 0.36925947 0.13279981 0.87561670 1.0 I I9 1 0.78793184 0.20008316 0.64567963 1.0 I I10 1 0.63074053 0.86720019 0.12438330 1.0 I I11 1 0.00631283 0.74309107 0.87637542 1.0