# generated using pymatgen data_Li2MnPCO7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.44506900 _cell_length_b 8.46801400 _cell_length_c 10.03582096 _cell_angle_alpha 86.42513179 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2MnPCO7 _chemical_formula_sum 'Li8 Mn4 P4 C4 O28' _cell_volume 546.65856722 _cell_formula_units_Z 4 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 0.21331800 0.73424200 0.87118800 1.0 Li Li1 1 0.78611000 0.73808300 0.87332500 1.0 Li Li2 1 0.21389000 0.73808300 0.37332500 1.0 Li Li3 1 0.78668200 0.73424200 0.37118800 1.0 Li Li4 1 0.28657300 0.26956200 0.62828100 1.0 Li Li5 1 0.71342700 0.26956200 0.12828100 1.0 Li Li6 1 0.49399400 0.10862500 0.88916300 1.0 Li Li7 1 0.50600600 0.10862500 0.38916300 1.0 Mn Mn8 1 0.50431200 0.66430000 0.59629100 1.0 Mn Mn9 1 0.49568800 0.66430000 0.09629100 1.0 Mn Mn10 1 0.00114100 0.32284300 0.90531100 1.0 Mn Mn11 1 0.99885900 0.32284300 0.40531100 1.0 P P12 1 0.00701500 0.58329100 0.63311500 1.0 P P13 1 0.99298500 0.58329100 0.13311500 1.0 P P14 1 0.49676700 0.41659800 0.85868100 1.0 P P15 1 0.50323300 0.41659800 0.35868100 1.0 C C16 1 0.49196600 0.95527400 0.64505600 1.0 C C17 1 0.50803400 0.95527400 0.14505600 1.0 C C18 1 0.99892000 0.04047900 0.86297300 1.0 C C19 1 0.00108000 0.04047900 0.36297300 1.0 O O20 1 0.50075000 0.93009000 0.51992800 1.0 O O21 1 0.00309900 0.89930000 0.82762900 1.0 O O22 1 0.49925000 0.93009000 0.01992800 1.0 O O23 1 0.50732200 0.82514300 0.72901200 1.0 O O24 1 0.99690100 0.89930000 0.32762900 1.0 O O25 1 0.49267800 0.82514300 0.22901200 1.0 O O26 1 0.19479600 0.68586400 0.58154300 1.0 O O27 1 0.81259000 0.67215600 0.57564200 1.0 O O28 1 0.18741000 0.67215600 0.07564200 1.0 O O29 1 0.80520400 0.68586400 0.08154300 1.0 O O30 1 0.50150900 0.58363100 0.91754500 1.0 O O31 1 0.00144700 0.56511700 0.78820200 1.0 O O32 1 0.49849100 0.58363100 0.41754500 1.0 O O33 1 0.99855300 0.56511700 0.28820200 1.0 O O34 1 0.48927900 0.44667100 0.70620000 1.0 O O35 1 0.02496300 0.41617000 0.57914600 1.0 O O36 1 0.51072100 0.44667100 0.20620000 1.0 O O37 1 0.97503700 0.41617000 0.07914600 1.0 O O38 1 0.31119200 0.31437600 0.90716400 1.0 O O39 1 0.68197500 0.31280000 0.90939900 1.0 O O40 1 0.68880800 0.31437600 0.40716400 1.0 O O41 1 0.31802500 0.31280000 0.40939900 1.0 O O42 1 0.01622500 0.16239100 0.77268400 1.0 O O43 1 0.46849300 0.08788700 0.69389300 1.0 O O44 1 0.98377500 0.16239100 0.27268400 1.0 O O45 1 0.97806100 0.08132900 0.98346200 1.0 O O46 1 0.53150700 0.08788700 0.19389300 1.0 O O47 1 0.02193900 0.08132900 0.48346200 1.0