# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.01813400
_cell_length_b   9.76869809
_cell_length_c   9.81412028
_cell_angle_alpha   116.38989148
_cell_angle_beta   92.73348775
_cell_angle_gamma   97.03287559
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   255.54615319
_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  0.78636000  0.57682900  0.14648000  1
  Li  Li1  1  0.06538800  0.13860200  0.28355600  1
  Li  Li2  1  0.36112200  0.72009800  0.42740600  1
  Li  Li3  1  0.63887800  0.27990200  0.57259400  1
  Li  Li4  1  0.93461200  0.86139800  0.71644400  1
  Li  Li5  1  0.21364000  0.42317100  0.85352000  1
  Li  Li6  1  0.50000000  0.00000000  0.00000000  1
  Li  Li7  1  0.00000000  0.00000000  0.50000000  1
  Mn  Mn8  1  0.86450500  0.71582500  0.93270900  1
  Mn  Mn9  1  0.13549500  0.28417500  0.06729100  1
  Co  Co10  1  0.42289500  0.86301800  0.22765000  1
  Co  Co11  1  0.70780200  0.42856600  0.35745200  1
  Co  Co12  1  0.29219800  0.57143400  0.64254800  1
  Co  Co13  1  0.57710500  0.13698200  0.77235000  1
  O  O14  1  0.30534300  0.66097500  0.04848300  1
  O  O15  1  0.57204700  0.22457300  0.18128100  1
  O  O16  1  0.86340200  0.79254800  0.31446800  1
  O  O17  1  0.19129100  0.36881500  0.46750300  1
  O  O18  1  0.47209400  0.94759400  0.62593500  1
  O  O19  1  0.77860800  0.51291100  0.75333100  1
  O  O20  1  0.01839900  0.08208600  0.89220300  1
  O  O21  1  0.22139200  0.48708900  0.24666900  1
  O  O22  1  0.52790600  0.05240600  0.37406500  1
  O  O23  1  0.80870900  0.63118500  0.53249700  1
  O  O24  1  0.13659800  0.20745200  0.68553200  1
  O  O25  1  0.42795300  0.77542700  0.81871900  1
  O  O26  1  0.69465700  0.33902500  0.95151700  1
  O  O27  1  0.98160100  0.91791400  0.10779700  1
