# generated using pymatgen
data_Li2CrO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.61446508
_cell_length_b   8.61442479
_cell_length_c   8.61438828
_cell_angle_alpha   107.80742812
_cell_angle_beta   107.80840902
_cell_angle_gamma   107.80859196
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CrO4
_chemical_formula_sum   'Li12 Cr6 O24'
_cell_volume   520.20109026
_cell_formula_units_Z   6
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  0.39640368  0.22304016  0.62275542  1
  Li  Li1  1  0.62275564  0.39640230  0.22303939  1
  Li  Li2  1  0.22304014  0.62275773  0.39640704  1
  Li  Li3  1  0.60359719  0.77696016  0.37724408  1
  Li  Li4  1  0.37724169  0.60359578  0.77695981  1
  Li  Li5  1  0.77695970  0.37724110  0.60359225  1
  Li  Li6  1  0.06451546  0.88708010  0.29499381  1
  Li  Li7  1  0.29499692  0.06451467  0.88708104  1
  Li  Li8  1  0.88708414  0.29499533  0.06451344  1
  Li  Li9  1  0.93548636  0.11292022  0.70500676  1
  Li  Li10  1  0.70500290  0.93548549  0.11291905  1
  Li  Li11  1  0.11291569  0.70500444  0.93548749  1
  Cr  Cr12  1  0.73589737  0.55304864  0.96081895  1
  Cr  Cr13  1  0.96082225  0.73590021  0.55304682  1
  Cr  Cr14  1  0.55304928  0.96081708  0.73589731  1
  Cr  Cr15  1  0.26410322  0.44695233  0.03918237  1
  Cr  Cr16  1  0.03917797  0.26409898  0.44695366  1
  Cr  Cr17  1  0.44695124  0.03918385  0.26410279  1
  O  O18  1  0.86536264  0.53666483  0.85606626  1
  O  O19  1  0.85606108  0.86537601  0.53666230  1
  O  O20  1  0.53666340  0.85606068  0.86537054  1
  O  O21  1  0.13463305  0.46333445  0.14393350  1
  O  O22  1  0.14394099  0.13462295  0.46333759  1
  O  O23  1  0.46333788  0.14394387  0.13462372  1
  O  O24  1  0.74360882  0.42890507  0.07261706  1
  O  O25  1  0.07261677  0.74360588  0.42890649  1
  O  O26  1  0.42890029  0.07262137  0.74360549  1
  O  O27  1  0.25639083  0.57109712  0.92738107  1
  O  O28  1  0.92738253  0.25639389  0.57109487  1
  O  O29  1  0.57110261  0.92737260  0.25639267  1
  O  O30  1  0.52589241  0.47503919  0.80859037  1
  O  O31  1  0.80857720  0.52588759  0.47503857  1
  O  O32  1  0.47503433  0.80858126  0.52588096  1
  O  O33  1  0.47411186  0.52496261  0.19141285  1
  O  O34  1  0.19142300  0.47411583  0.52496404  1
  O  O35  1  0.52496949  0.19142473  0.47412688  1
  O  O36  1  0.81338588  0.76676229  0.10484752  1
  O  O37  1  0.10484396  0.81338766  0.76676842  1
  O  O38  1  0.76677311  0.10485654  0.81338847  1
  O  O39  1  0.18661339  0.23323354  0.89515011  1
  O  O40  1  0.89515405  0.18661117  0.23322902  1
  O  O41  1  0.23322157  0.89514229  0.18660872  1
