# generated using pymatgen
data_LiCr2O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.95719800
_cell_length_b   5.95719800
_cell_length_c   8.30186000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCr2O4
_chemical_formula_sum   'Li4 Cr8 O16'
_cell_volume   294.61813456
_cell_formula_units_Z   4
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  0.25281800  0.25281800  0.12500000  1
  Li  Li1  1  0.25281800  0.74718200  0.37500000  1
  Li  Li2  1  0.74718200  0.25281800  0.87500000  1
  Li  Li3  1  0.74718200  0.74718200  0.62500000  1
  Cr  Cr4  1  0.24467000  0.50000000  0.75000000  1
  Cr  Cr5  1  0.00000000  0.75035700  0.00000000  1
  Cr  Cr6  1  0.50000000  0.24467000  0.50000000  1
  Cr  Cr7  1  0.75035700  0.00000000  0.25000000  1
  Cr  Cr8  1  0.24964300  0.00000000  0.75000000  1
  Cr  Cr9  1  0.50000000  0.75533000  0.00000000  1
  Cr  Cr10  1  0.00000000  0.24964300  0.50000000  1
  Cr  Cr11  1  0.75533000  0.50000000  0.25000000  1
  O  O12  1  0.24414100  0.46561000  0.50737900  1
  O  O13  1  0.46561000  0.24414100  0.74262100  1
  O  O14  1  0.75721100  0.98048500  0.01734500  1
  O  O15  1  0.24414100  0.53439000  0.99262100  1
  O  O16  1  0.98048500  0.75721100  0.23265500  1
  O  O17  1  0.01951500  0.75721100  0.76734500  1
  O  O18  1  0.75721100  0.01951500  0.48265500  1
  O  O19  1  0.53439000  0.24414100  0.25737900  1
  O  O20  1  0.46561000  0.75585900  0.75737900  1
  O  O21  1  0.24278900  0.98048500  0.98265500  1
  O  O22  1  0.98048500  0.24278900  0.26734500  1
  O  O23  1  0.01951500  0.24278900  0.73265500  1
  O  O24  1  0.75585900  0.46561000  0.49262100  1
  O  O25  1  0.24278900  0.01951500  0.51734500  1
  O  O26  1  0.53439000  0.75585900  0.24262100  1
  O  O27  1  0.75585900  0.53439000  0.00737900  1
