# generated using pymatgen
data_LiCr2O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.94437067
_cell_length_b   5.94437067
_cell_length_c   5.94437067
_cell_angle_alpha   120.89308541
_cell_angle_beta   119.29340728
_cell_angle_gamma   89.84416680
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCr2O4
_chemical_formula_sum   'Li2 Cr4 O8'
_cell_volume   148.27987412
_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  0.00000000  0.50000000  0.50000000  1
  Li  Li1  1  0.50000000  0.50000000  0.00000000  1
  Cr  Cr2  1  0.50000000  0.50000000  0.50000000  1
  Cr  Cr3  1  0.00000000  0.00000000  0.00000000  1
  Cr  Cr4  1  0.50000000  0.00000000  0.00000000  1
  Cr  Cr5  1  0.50000000  0.00000000  0.50000000  1
  O  O6  1  0.29476600  0.75900500  0.53576100  1
  O  O7  1  0.73079400  0.74766300  0.51686900  1
  O  O8  1  0.72324400  0.75900500  0.96423900  1
  O  O9  1  0.26920600  0.78607400  0.01686900  1
  O  O10  1  0.27675600  0.24099500  0.03576100  1
  O  O11  1  0.26920600  0.25233700  0.48313100  1
  O  O12  1  0.73079400  0.21392600  0.98313100  1
  O  O13  1  0.70523400  0.24099500  0.46423900  1
