# generated using pymatgen data_Mn4O7F _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.69800796 _cell_length_b 5.50849174 _cell_length_c 6.69800796 _cell_angle_alpha 89.89942523 _cell_angle_beta 96.08322152 _cell_angle_gamma 90.10057477 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn4O7F _chemical_formula_sum 'Mn8 O14 F2' _cell_volume 245.73691206 _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 0.37286500 0.35223900 0.11688100 1.0 Mn Mn1 1 0.11654000 0.66985700 0.37607300 1.0 Mn Mn2 1 0.13311900 0.85223900 0.87713500 1.0 Mn Mn3 1 0.87392700 0.16985700 0.13346000 1.0 Mn Mn4 1 0.38255600 0.13051900 0.63233200 1.0 Mn Mn5 1 0.62382200 0.85552800 0.37127800 1.0 Mn Mn6 1 0.61766800 0.63051900 0.86744400 1.0 Mn Mn7 1 0.87872200 0.35552800 0.62617800 1.0 O O8 1 0.15316400 0.11450200 0.07735000 1.0 O O9 1 0.17265000 0.61450200 0.09683600 1.0 O O10 1 0.57520000 0.60759100 0.15077900 1.0 O O11 1 0.08012800 0.61488700 0.65727700 1.0 O O12 1 0.34647600 0.88914800 0.42551100 1.0 O O13 1 0.09922100 0.10759100 0.67480000 1.0 O O14 1 0.59272300 0.11488700 0.16987200 1.0 O O15 1 0.41006000 0.88531600 0.83240400 1.0 O O16 1 0.65888500 0.10650500 0.57913800 1.0 O O17 1 0.89827500 0.89556600 0.32025300 1.0 O O18 1 0.41759600 0.38531600 0.83994000 1.0 O O19 1 0.67086200 0.60650500 0.59111500 1.0 O O20 1 0.92974700 0.39556600 0.35172500 1.0 O O21 1 0.82448900 0.38914800 0.90352400 1.0 F F22 1 0.33343300 0.37834200 0.41212900 1.0 F F23 1 0.83787100 0.87834200 0.91656700 1.0