# generated using pymatgen data_Li3Mn2P2(CO7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.47932000 _cell_length_b 8.29658768 _cell_length_c 10.10134891 _cell_angle_alpha 85.69766062 _cell_angle_beta 89.81364876 _cell_angle_gamma 89.52452022 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li3Mn2P2(CO7)2 _chemical_formula_sum 'Li6 Mn4 P4 C4 O28' _cell_volume 541.45990870 _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 Li Li0 1 0.02184300 0.73888200 0.87449800 1.0 Li Li1 1 0.47874000 0.74392100 0.87442200 1.0 Li Li2 1 0.05314900 0.72546800 0.38063900 1.0 Li Li3 1 0.97008000 0.26979800 0.63341500 1.0 Li Li4 1 0.53431400 0.26326600 0.11523300 1.0 Li Li5 1 0.74114700 0.09759700 0.38363400 1.0 Mn Mn6 1 0.74394300 0.67054300 0.59757900 1.0 Mn Mn7 1 0.75038200 0.66840800 0.10425200 1.0 Mn Mn8 1 0.24642300 0.32993900 0.89863200 1.0 Mn Mn9 1 0.25205100 0.32852900 0.39706500 1.0 P P10 1 0.24312300 0.57995400 0.63725600 1.0 P P11 1 0.25187900 0.57820300 0.13420100 1.0 P P12 1 0.75206700 0.42042200 0.86153000 1.0 P P13 1 0.75161900 0.42045400 0.36036000 1.0 C C14 1 0.75818700 0.95739800 0.64540900 1.0 C C15 1 0.74870400 0.94891200 0.14927600 1.0 C C16 1 0.24682600 0.04643100 0.85744000 1.0 C C17 1 0.24649900 0.04550300 0.35346700 1.0 O O18 1 0.75133300 0.91428500 0.52342000 1.0 O O19 1 0.24677800 0.89913000 0.83547400 1.0 O O20 1 0.74377100 0.90069000 0.02879500 1.0 O O21 1 0.74449500 0.82950700 0.73430500 1.0 O O22 1 0.22710700 0.90303200 0.32785600 1.0 O O23 1 0.77338100 0.82674000 0.23978700 1.0 O O24 1 0.06020800 0.69162400 0.59114200 1.0 O O25 1 0.43773700 0.67441900 0.59813600 1.0 O O26 1 0.06239300 0.67491300 0.07805900 1.0 O O27 1 0.43744100 0.68567100 0.08995300 1.0 O O28 1 0.74520900 0.59007100 0.92154300 1.0 O O29 1 0.23635500 0.54649000 0.79362100 1.0 O O30 1 0.77091800 0.58085700 0.42615200 1.0 O O31 1 0.23237500 0.54325900 0.28761000 1.0 O O32 1 0.76357600 0.45777100 0.70829500 1.0 O O33 1 0.22408700 0.41576300 0.57510600 1.0 O O34 1 0.74277100 0.46040300 0.20733500 1.0 O O35 1 0.27322800 0.41193100 0.07485600 1.0 O O36 1 0.94006500 0.31906800 0.90914900 1.0 O O37 1 0.56223600 0.32050100 0.90841000 1.0 O O38 1 0.56447700 0.31483400 0.40262600 1.0 O O39 1 0.93241700 0.30285300 0.40183500 1.0 O O40 1 0.23140300 0.16524400 0.76404600 1.0 O O41 1 0.77694500 0.09735400 0.67719500 1.0 O O42 1 0.27233900 0.16700600 0.26205900 1.0 O O43 1 0.26288700 0.09981300 0.97515100 1.0 O O44 1 0.72785000 0.09095300 0.18137600 1.0 O O45 1 0.24143200 0.09841700 0.47323200 1.0