# generated using pymatgen data_SmF3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.37738984 _cell_length_b 6.64583764 _cell_length_c 7.02451377 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmF3 _chemical_formula_sum 'Sm4 F12' _cell_volume 204.35309558 _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 Sm Sm0 1 0.93422798 0.63183677 0.75000000 1.0 Sm Sm1 1 0.43422798 0.86816323 0.25000000 1.0 Sm Sm2 1 0.56577202 0.13183677 0.75000000 1.0 Sm Sm3 1 0.06577202 0.36816323 0.25000000 1.0 F F4 1 0.07481283 0.98138921 0.75000000 1.0 F F5 1 0.57481283 0.51861079 0.25000000 1.0 F F6 1 0.42518717 0.48138921 0.75000000 1.0 F F7 1 0.92518717 0.01861079 0.25000000 1.0 F F8 1 0.39395352 0.16560295 0.06482613 1.0 F F9 1 0.89395352 0.33439705 0.93517287 1.0 F F10 1 0.10604648 0.66560295 0.43517287 1.0 F F11 1 0.60604648 0.83439705 0.56482713 1.0 F F12 1 0.60604648 0.83439705 0.93517287 1.0 F F13 1 0.10604648 0.66560295 0.06482613 1.0 F F14 1 0.89395352 0.33439705 0.56482713 1.0 F F15 1 0.39395352 0.16560295 0.43517287 1.0