data_Li2(NiO2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.88
_cell_length_b   5.85
_cell_length_c   6.54
_cell_angle_alpha   73.92
_cell_angle_beta   77.94
_cell_angle_gamma   87.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2(NiO2)3
_chemical_formula_sum   'Li2 Ni3 O6'
_cell_volume   103.38
_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  0.45  0.67  0.91  1.0
  Li  Li1  1  0.05  0.93  0.24  1.0
  Ni  Ni2  1  0.0  0.0  0.0  1.0
  Ni  Ni3  1  0.61  0.49  0.03  1.0
  Ni  Ni4  1  0.89  0.11  0.11  1.0
  O  O5  1  0.69  0.62  0.11  1.0
  O  O6  1  0.81  0.98  0.04  1.0
  O  O7  1  0.2  0.89  0.88  1.0
  O  O8  1  0.3  0.71  0.26  1.0
  O  O9  1  0.61  0.49  0.93  1.0
  O  O10  1  0.89  0.11  0.21  1.0

data_Li2(NiO2)3
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.88
_cell_length_b   5.85
_cell_length_c   6.54
_cell_angle_alpha   73.92
_cell_angle_beta   77.94
_cell_angle_gamma   87.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2(NiO2)3
_chemical_formula_sum   'Li2 Ni3 O6'
_cell_volume   103.38
_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  0.05  0.93  0.24  1.0
  Li  Li1  1  0.45  0.67  0.91  1.0
  Ni  Ni2  1  0.0  0.0  0.0  1.0
  Ni  Ni3  1  0.61  0.49  0.03  1.0
  Ni  Ni4  1  0.89  0.11  0.11  1.0
  O  O5  1  0.2  0.89  0.88  1.0
  O  O6  1  0.3  0.71  0.26  1.0
  O  O7  1  0.61  0.49  0.93  1.0
  O  O8  1  0.69  0.62  0.11  1.0
  O  O9  1  0.81  0.98  0.04  1.0
  O  O10  1  0.89  0.11  0.21  1.0

Li Li Ni Ni Ni O O O O O O