# generated using pymatgen data_Mn6O5F7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.28192800 _cell_length_b 5.36521137 _cell_length_c 14.83199585 _cell_angle_alpha 93.87400737 _cell_angle_beta 91.76796709 _cell_angle_gamma 91.58136315 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn6O5F7 _chemical_formula_sum 'Mn12 O10 F14' _cell_volume 418.97315053 _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 0.98482400 0.97358500 0.00185200 1.0 Mn Mn1 1 0.47957900 0.15681300 0.83002300 1.0 Mn Mn2 1 0.98674900 0.89266700 0.66506500 1.0 Mn Mn3 1 0.53027700 0.94667300 0.49290700 1.0 Mn Mn4 1 0.94289500 0.98496100 0.33214900 1.0 Mn Mn5 1 0.43981000 0.94760100 0.17910900 1.0 Mn Mn6 1 0.97663800 0.48062200 0.83335200 1.0 Mn Mn7 1 0.52159800 0.61581400 0.98789000 1.0 Mn Mn8 1 0.61599400 0.49169000 0.34149300 1.0 Mn Mn9 1 0.99308700 0.43776500 0.49319200 1.0 Mn Mn10 1 0.41221600 0.53295000 0.67377600 1.0 Mn Mn11 1 0.91652100 0.58869900 0.16195400 1.0 O O12 1 0.83986900 0.69813700 0.41937100 1.0 O O13 1 0.18148300 0.66893600 0.58469900 1.0 O O14 1 0.70735700 0.83551500 0.08839800 1.0 O O15 1 0.13151400 0.81380000 0.23827900 1.0 O O16 1 0.82330600 0.69245300 0.92423600 1.0 O O17 1 0.14536000 0.69150100 0.75128600 1.0 O O18 1 0.65352300 0.78697300 0.26413300 1.0 O O19 1 0.74266000 0.21446900 0.41143300 1.0 O O20 1 0.64648600 0.40909200 0.76497900 1.0 O O21 1 0.31289700 0.41562000 0.90001000 1.0 F F22 1 0.64690700 0.91709100 0.74542300 1.0 F F23 1 0.33487800 0.93415600 0.92207600 1.0 F F24 1 0.33732000 0.62850900 0.41909000 1.0 F F25 1 0.22214500 0.63806900 0.06862300 1.0 F F26 1 0.68460000 0.66317700 0.58915400 1.0 F F27 1 0.73416100 0.35690700 0.07683000 1.0 F F28 1 0.41029000 0.20445000 0.59376400 1.0 F F29 1 0.41447000 0.28294900 0.25694000 1.0 F F30 1 0.90506500 0.13568600 0.57414600 1.0 F F31 1 0.83837100 0.19342400 0.90513000 1.0 F F32 1 0.91083200 0.31883500 0.24899300 1.0 F F33 1 0.21553600 0.12165300 0.41752500 1.0 F F34 1 0.23087000 0.13094400 0.09547100 1.0 F F35 1 0.12991100 0.19781500 0.74725000 1.0