# generated using pymatgen
data_Li4Mn3Co3(NiO8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.73642351
_cell_length_b   5.73642351
_cell_length_c   9.55577939
_cell_angle_alpha   89.94265643
_cell_angle_beta   89.94265643
_cell_angle_gamma   60.17458024
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn3Co3(NiO8)2
_chemical_formula_sum   'Li4 Mn3 Co3 Ni2 O16'
_cell_volume   272.79737672
_cell_formula_units_Z   1
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  0.66430700  0.66430700  0.10524100  1
  Li  Li1  1  0.00479700  0.00479700  0.00113300  1
  Li  Li2  1  0.00577000  0.00577000  0.50390300  1
  Li  Li3  1  0.33066700  0.33066700  0.60914700  1
  Mn  Mn4  1  0.82981800  0.82981800  0.78430200  1
  Mn  Mn5  1  0.16768700  0.66185500  0.28464500  1
  Mn  Mn6  1  0.66185500  0.16768700  0.28464500  1
  Co  Co7  1  0.33586800  0.83053700  0.78666900  1
  Co  Co8  1  0.83053700  0.33586800  0.78666900  1
  Co  Co9  1  0.16795400  0.16795400  0.28658000  1
  Ni  Ni10  1  0.66702600  0.66702600  0.51105200  1
  Ni  Ni11  1  0.33426600  0.33426600  0.00958700  1
  O  O12  1  0.31886800  0.84591800  0.39161700  1
  O  O13  1  0.51679800  0.51679800  0.67572500  1
  O  O14  1  0.66562500  0.66562500  0.89135400  1
  O  O15  1  0.00044500  0.00044500  0.68925700  1
  O  O16  1  0.00082200  0.00082200  0.18739700  1
  O  O17  1  0.84591800  0.31886800  0.39161700  1
  O  O18  1  0.51187000  0.96393700  0.67032200  1
  O  O19  1  0.96393700  0.51187000  0.67032200  1
  O  O20  1  0.15969500  0.15969500  0.88720500  1
  O  O21  1  0.84237000  0.84237000  0.39633500  1
  O  O22  1  0.03308300  0.47768800  0.17022800  1
  O  O23  1  0.47768800  0.03308300  0.17022800  1
  O  O24  1  0.33343300  0.33343300  0.39240600  1
  O  O25  1  0.16228500  0.68354200  0.89309000  1
  O  O26  1  0.48260500  0.48260500  0.16839300  1
  O  O27  1  0.68354200  0.16228500  0.89309000  1
