# generated using pymatgen data_AlFe3F15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.64688000 _cell_length_b 5.34730411 _cell_length_c 5.34730372 _cell_angle_alpha 76.75976686 _cell_angle_beta 71.33899890 _cell_angle_gamma 71.33898568 _symmetry_Int_Tables_number 1 _chemical_formula_structural AlFe3F15 _chemical_formula_sum 'Al1 Fe3 F15' _cell_volume 245.12205563 _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 Al Al0 1 0.83333300 0.50000000 0.50000000 1.0 Fe Fe1 1 0.01231500 0.00068000 0.00068000 1.0 Fe Fe2 1 0.33333300 0.00000000 0.00000000 1.0 Fe Fe3 1 0.65435200 0.99932000 0.99932000 1.0 F F4 1 0.17037200 0.82194900 0.18975500 1.0 F F5 1 0.49629500 0.81024500 0.17805100 1.0 F F6 1 0.83333300 0.80213500 0.19786500 1.0 F F7 1 0.17037200 0.18975500 0.82194900 1.0 F F8 1 0.49629500 0.17805100 0.81024500 1.0 F F9 1 0.83333300 0.19786500 0.80213500 1.0 F F10 1 0.25763100 0.22905600 0.22905600 1.0 F F11 1 0.58217700 0.23401000 0.23401000 1.0 F F12 1 0.91222600 0.25569400 0.25569400 1.0 F F13 1 0.08449000 0.76599000 0.76599000 1.0 F F14 1 0.40903500 0.77094400 0.77094400 1.0 F F15 1 0.75444100 0.74430600 0.74430600 1.0 F F16 1 0.01198100 0.49729600 0.49729600 1.0 F F17 1 0.33333300 0.50000000 0.50000000 1.0 F F18 1 0.65468600 0.50270400 0.50270400 1.0