# generated using pymatgen
data_Li6Cr2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05893400
_cell_length_b   7.87024400
_cell_length_c   9.10372714
_cell_angle_alpha   64.13506980
_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   326.15533252
_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  0.20099600  0.33576200  0.88264000  1
  Li  Li1  1  0.80963300  0.58076400  0.85612100  1
  Li  Li2  1  0.80889000  0.07015400  0.83441800  1
  Li  Li3  1  0.80963300  0.41923600  0.64387900  1
  Li  Li4  1  0.20099600  0.66423800  0.61736000  1
  Li  Li5  1  0.80889000  0.92984600  0.66558200  1
  Li  Li6  1  0.19111000  0.07015400  0.33441800  1
  Li  Li7  1  0.79900400  0.33576200  0.38264000  1
  Li  Li8  1  0.19036700  0.58076400  0.35612100  1
  Li  Li9  1  0.19111000  0.92984600  0.16558200  1
  Li  Li10  1  0.19036700  0.41923600  0.14387900  1
  Li  Li11  1  0.79900400  0.66423800  0.11736000  1
  Cr  Cr12  1  0.31263000  0.78060200  0.90416600  1
  Cr  Cr13  1  0.31263000  0.21939800  0.59583400  1
  Cr  Cr14  1  0.68737000  0.78060200  0.40416600  1
  Cr  Cr15  1  0.68737000  0.21939800  0.09583400  1
  O  O16  1  0.80334200  0.28032600  0.89375400  1
  O  O17  1  0.21426000  0.59505500  0.85712100  1
  O  O18  1  0.66560000  0.81093000  0.89369600  1
  O  O19  1  0.21426000  0.40494500  0.64287900  1
  O  O20  1  0.15200600  0.00000000  0.75000000  1
  O  O21  1  0.80334200  0.71967400  0.60624600  1
  O  O22  1  0.66560000  0.18907000  0.60630400  1
  O  O23  1  0.33440000  0.81093000  0.39369600  1
  O  O24  1  0.19665800  0.28032600  0.39375400  1
  O  O25  1  0.84799400  0.00000000  0.25000000  1
  O  O26  1  0.78574000  0.59505500  0.35712100  1
  O  O27  1  0.33440000  0.18907000  0.10630400  1
  O  O28  1  0.78574000  0.40494500  0.14287900  1
  O  O29  1  0.19665800  0.71967400  0.10624600  1
