# generated using pymatgen data_Li5Mn2P2(CO7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.43937500 _cell_length_b 9.57784300 _cell_length_c 10.10127093 _cell_angle_alpha 62.17437251 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Mn2P2(CO7)2 _chemical_formula_sum 'Li10 Mn4 P4 C4 O28' _cell_volume 550.96317408 _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 0.25000000 0.09201300 0.32382800 1.0 Li Li1 1 0.02709500 0.26193300 0.49721600 1.0 Li Li2 1 0.47290500 0.26193300 0.49721600 1.0 Li Li3 1 0.48084300 0.25536100 0.99025100 1.0 Li Li4 1 0.01915700 0.25536100 0.99025100 1.0 Li Li5 1 0.97290500 0.73806700 0.50278400 1.0 Li Li6 1 0.52709500 0.73806700 0.50278400 1.0 Li Li7 1 0.98084300 0.74463900 0.00974900 1.0 Li Li8 1 0.51915700 0.74463900 0.00974900 1.0 Li Li9 1 0.75000000 0.90798700 0.67617200 1.0 Mn Mn10 1 0.75000000 0.33704000 0.68088900 1.0 Mn Mn11 1 0.75000000 0.33775400 0.19039400 1.0 Mn Mn12 1 0.25000000 0.66296000 0.31911100 1.0 Mn Mn13 1 0.25000000 0.66224600 0.80960600 1.0 P P14 1 0.25000000 0.41513900 0.67875400 1.0 P P15 1 0.25000000 0.41617000 0.18223200 1.0 P P16 1 0.75000000 0.58486100 0.32124600 1.0 P P17 1 0.75000000 0.58383000 0.81776800 1.0 C C18 1 0.75000000 0.03962500 0.37795900 1.0 C C19 1 0.75000000 0.04044200 0.86981200 1.0 C C20 1 0.25000000 0.96037500 0.62204100 1.0 C C21 1 0.25000000 0.95955800 0.13018800 1.0 O O22 1 0.75000000 0.07702900 0.72899800 1.0 O O23 1 0.75000000 0.07926300 0.23864700 1.0 O O24 1 0.25000000 0.10647000 0.51587600 1.0 O O25 1 0.75000000 0.15181000 0.42006900 1.0 O O26 1 0.25000000 0.10142100 0.02620300 1.0 O O27 1 0.75000000 0.16146900 0.90013000 1.0 O O28 1 0.05936700 0.32342800 0.66768800 1.0 O O29 1 0.44063300 0.32342800 0.66768800 1.0 O O30 1 0.06363300 0.31328900 0.18013600 1.0 O O31 1 0.43636700 0.31328900 0.18013600 1.0 O O32 1 0.75000000 0.41256100 0.45278500 1.0 O O33 1 0.25000000 0.43040500 0.32953300 1.0 O O34 1 0.75000000 0.41638900 0.95247500 1.0 O O35 1 0.25000000 0.42709200 0.82734300 1.0 O O36 1 0.75000000 0.56959500 0.67046700 1.0 O O37 1 0.25000000 0.58743900 0.54721500 1.0 O O38 1 0.75000000 0.57290800 0.17265700 1.0 O O39 1 0.25000000 0.58361100 0.04752500 1.0 O O40 1 0.94063300 0.67657200 0.33231200 1.0 O O41 1 0.55936700 0.67657200 0.33231200 1.0 O O42 1 0.56363300 0.68671100 0.81986400 1.0 O O43 1 0.93636700 0.68671100 0.81986400 1.0 O O44 1 0.25000000 0.84819000 0.57993100 1.0 O O45 1 0.75000000 0.89353000 0.48412400 1.0 O O46 1 0.25000000 0.83853100 0.09987000 1.0 O O47 1 0.75000000 0.89857900 0.97379700 1.0 O O48 1 0.25000000 0.92297100 0.27100200 1.0 O O49 1 0.25000000 0.92073700 0.76135300 1.0