# generated using pymatgen data_Mn4O7F _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.95299500 _cell_length_b 6.98417400 _cell_length_c 7.11140010 _cell_angle_alpha 78.34676799 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn4O7F _chemical_formula_sum 'Mn8 O14 F2' _cell_volume 240.93108538 _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 Mn Mn0 1 0.51157800 0.58106800 0.07714500 1.0 Mn Mn1 1 0.99277100 0.92893100 0.42555900 1.0 Mn Mn2 1 0.50498100 0.07180700 0.07237500 1.0 Mn Mn3 1 0.97378000 0.41980600 0.43755200 1.0 Mn Mn4 1 0.48842200 0.58106800 0.57714500 1.0 Mn Mn5 1 0.00722900 0.92893100 0.92555900 1.0 Mn Mn6 1 0.02622000 0.41980600 0.93755200 1.0 Mn Mn7 1 0.49501900 0.07180700 0.57237500 1.0 O O8 1 0.17794700 0.93559400 0.17049700 1.0 O O9 1 0.68349600 0.83203500 0.05870600 1.0 O O10 1 0.34424000 0.32661800 0.06020000 1.0 O O11 1 0.82205300 0.93559400 0.67049700 1.0 O O12 1 0.31650400 0.83203500 0.55870600 1.0 O O13 1 0.83619600 0.43843600 0.17431100 1.0 O O14 1 0.81412300 0.67330700 0.43369400 1.0 O O15 1 0.16380400 0.43843600 0.67431100 1.0 O O16 1 0.65576000 0.32661800 0.56020000 1.0 O O17 1 0.18587700 0.67330700 0.93369400 1.0 O O18 1 0.66718500 0.06274000 0.32798300 1.0 O O19 1 0.16340800 0.17377400 0.43842800 1.0 O O20 1 0.33281500 0.06274000 0.82798300 1.0 O O21 1 0.83659200 0.17377400 0.93842800 1.0 F F22 1 0.29307100 0.55588500 0.32355100 1.0 F F23 1 0.70692900 0.55588500 0.82355100 1.0