# generated using pymatgen
data_Li2CrNiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.93937500
_cell_length_b   5.09343600
_cell_length_c   5.09980573
_cell_angle_alpha   70.64068640
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CrNiO4
_chemical_formula_sum   'Li2 Cr1 Ni1 O4'
_cell_volume   72.03477230
_cell_formula_units_Z   1
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  0.00000000  0.00000000  1
  Li  Li1  1  0.50000000  0.00000000  0.50000000  1
  Cr  Cr2  1  0.00000000  0.50000000  0.50000000  1
  Ni  Ni3  1  0.50000000  0.50000000  0.00000000  1
  O  O4  1  0.00000000  0.28013700  0.24818900  1
  O  O5  1  0.50000000  0.26738200  0.73069800  1
  O  O6  1  0.00000000  0.71986300  0.75181100  1
  O  O7  1  0.50000000  0.73261800  0.26930200  1
