# generated using pymatgen
data_Li4Mn3Fe3(CuO8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87602398
_cell_length_b   5.83580560
_cell_length_c   9.57540278
_cell_angle_alpha   90.00443342
_cell_angle_beta   89.31212353
_cell_angle_gamma   119.77195287
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn3Fe3(CuO8)2
_chemical_formula_sum   'Li4 Mn3 Fe3 Cu2 O16'
_cell_volume   284.98643501
_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  0.33882300  0.66946300  0.89569700  1.0
  Li  Li1  1  0.99598700  0.99793300  0.99660900  1.0
  Li  Li2  1  0.00044600  0.00015600  0.49539700  1.0
  Li  Li3  1  0.67009800  0.33505200  0.39617900  1.0
  Mn  Mn4  1  0.65767700  0.82887100  0.21391500  1.0
  Mn  Mn5  1  0.82931200  0.66036500  0.71396300  1.0
  Mn  Mn6  1  0.82932600  0.16896000  0.71395500  1.0
  Fe  Fe7  1  0.16679200  0.83020000  0.21255300  1.0
  Fe  Fe8  1  0.16678300  0.33667600  0.21252800  1.0
  Fe  Fe9  1  0.33584100  0.16792600  0.71284900  1.0
  Cu  Cu10  1  0.32641300  0.66319500  0.48793500  1.0
  Cu  Cu11  1  0.66101100  0.33053200  0.98811900  1.0
  O  O12  1  0.15765400  0.83367200  0.60337900  1.0
  O  O13  1  0.04134200  0.52071400  0.34008600  1.0
  O  O14  1  0.34465100  0.67235000  0.10347600  1.0
  O  O15  1  0.98605900  0.99310100  0.30958600  1.0
  O  O16  1  0.98671900  0.99337800  0.81050900  1.0
  O  O17  1  0.15764700  0.32391500  0.60335700  1.0
  O  O18  1  0.48763900  0.96175000  0.33751600  1.0
  O  O19  1  0.48767600  0.52595900  0.33750300  1.0
  O  O20  1  0.32687200  0.16346200  0.10142200  1.0
  O  O21  1  0.68370900  0.84183800  0.60534300  1.0
  O  O22  1  0.52741300  0.48832000  0.83588000  1.0
  O  O23  1  0.52742600  0.03916000  0.83588100  1.0
  O  O24  1  0.68090600  0.34045100  0.60649900  1.0
  O  O25  1  0.83133200  0.67315000  0.10310300  1.0
  O  O26  1  0.96311200  0.48156600  0.83151600  1.0
  O  O27  1  0.83133100  0.15818700  0.10308000  1.0