# generated using pymatgen
data_Li3Cu(NiO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.36560357
_cell_length_b   6.36560357
_cell_length_c   5.87514440
_cell_angle_alpha   75.88651548
_cell_angle_beta   75.88651548
_cell_angle_gamma   26.67243492
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Cu(NiO3)2
_chemical_formula_sum   'Li3 Cu1 Ni2 O6'
_cell_volume   103.45530068
_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  0.50000000  0.50000000  0.50000000  1
  Li  Li1  1  0.16838700  0.16838700  0.16407600  1
  Li  Li2  1  0.83161300  0.83161300  0.83592400  1
  Cu  Cu3  1  0.50000000  0.50000000  0.00000000  1
  Ni  Ni4  1  0.16807700  0.16807700  0.66813300  1
  Ni  Ni5  1  0.83192300  0.83192300  0.33186700  1
  O  O6  1  0.66247100  0.66247100  0.90455300  1
  O  O7  1  0.32480100  0.32480100  0.57651000  1
  O  O8  1  0.33752900  0.33752900  0.09544700  1
  O  O9  1  0.98924000  0.98924000  0.24360700  1
  O  O10  1  0.01076000  0.01076000  0.75639300  1
  O  O11  1  0.67519900  0.67519900  0.42349000  1
