# generated using pymatgen
data_Li6Cr2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.76827300
_cell_length_b   5.03727400
_cell_length_c   9.25612386
_cell_angle_alpha   80.15904206
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Cr2O7
_chemical_formula_sum   'Li12 Cr4 O14'
_cell_volume   264.99204606
_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  0.78366400  0.36695900  0.86310500  1
  Li  Li1  1  0.23106900  0.36883200  0.86831700  1
  Li  Li2  1  0.50469000  0.94021200  0.86955200  1
  Li  Li3  1  0.73106900  0.13116800  0.63168300  1
  Li  Li4  1  0.28366400  0.13304100  0.63689500  1
  Li  Li5  1  0.00469000  0.55978800  0.63044800  1
  Li  Li6  1  0.99531000  0.44021200  0.36955200  1
  Li  Li7  1  0.71633600  0.86695900  0.36310500  1
  Li  Li8  1  0.26893100  0.86883200  0.36831700  1
  Li  Li9  1  0.49531000  0.05978800  0.13044800  1
  Li  Li10  1  0.76893100  0.63116800  0.13168300  1
  Li  Li11  1  0.21633600  0.63304100  0.13689500  1
  Cr  Cr12  1  0.00706400  0.87055700  0.86685300  1
  Cr  Cr13  1  0.50706400  0.62944300  0.63314700  1
  Cr  Cr14  1  0.49293600  0.37055700  0.36685300  1
  Cr  Cr15  1  0.99293600  0.12944300  0.13314700  1
  O  O16  1  0.00000000  0.50000000  0.00000000  1
  O  O17  1  0.77764600  0.99393300  0.99584800  1
  O  O18  1  0.00819700  0.19888200  0.74640400  1
  O  O19  1  0.50819700  0.30111800  0.75359600  1
  O  O20  1  0.27168600  0.75211200  0.76079800  1
  O  O21  1  0.77168600  0.74788800  0.73920200  1
  O  O22  1  0.27764600  0.50606700  0.50415200  1
  O  O23  1  0.72235400  0.49393300  0.49584800  1
  O  O24  1  0.50000000  0.00000000  0.50000000  1
  O  O25  1  0.22831400  0.25211200  0.26079800  1
  O  O26  1  0.72831400  0.24788800  0.23920200  1
  O  O27  1  0.49180300  0.69888200  0.24640400  1
  O  O28  1  0.99180300  0.80111800  0.25359600  1
  O  O29  1  0.22235400  0.00606700  0.00415200  1
