data_Li2Nb4ZnO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24
_cell_length_b   5.61
_cell_length_c   7.69
_cell_angle_alpha   95.25
_cell_angle_beta   90.14
_cell_angle_gamma   90.19
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Nb4ZnO12
_chemical_formula_sum   'Li2 Nb4 Zn1 O12'
_cell_volume   225.49
_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  0.62  0.1  0.12  1.0
  Li  Li1  1  0.21  0.88  0.02  1.0
  Nb  Nb2  1  0.63  0.11  0.62  1.0
  Nb  Nb3  1  0.59  0.5  0.91  1.0
  Nb  Nb4  1  0.21  0.67  0.84  1.0
  Nb  Nb5  1  1.0  0.86  0.6  1.0
  Zn  Zn6  1  0.22  0.28  0.08  1.0
  O  O7  1  0.27  0.6  0.13  1.0
  O  O8  1  0.3  0.88  0.79  1.0
  O  O9  1  0.57  0.35  0.02  1.0
  O  O10  1  0.6  0.14  0.78  1.0
  O  O11  1  0.24  0.37  0.04  1.0
  O  O12  1  0.63  0.72  0.39  1.0
  O  O13  1  0.68  0.68  0.09  1.0
  O  O14  1  0.52  0.76  0.63  1.0
  O  O15  1  0.96  0.95  0.35  1.0
  O  O16  1  0.9  0.46  0.64  1.0
  O  O17  1  0.58  0.01  0.18  1.0
  O  O18  1  0.97  0.75  0.16  1.0

data_Li2Nb4ZnO12
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.24
_cell_length_b   5.61
_cell_length_c   7.69
_cell_angle_alpha   95.25
_cell_angle_beta   90.14
_cell_angle_gamma   90.19
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Nb4ZnO12
_chemical_formula_sum   'Li2 Nb4 Zn1 O12'
_cell_volume   225.49
_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  0.21  0.88  0.02  1.0
  Li  Li1  1  0.62  0.1  0.12  1.0
  Nb  Nb2  1  0.21  0.67  0.84  1.0
  Nb  Nb3  1  0.59  0.5  0.91  1.0
  Nb  Nb4  1  0.63  0.11  0.62  1.0
  Nb  Nb5  1  1.0  0.86  0.6  1.0
  Zn  Zn6  1  0.22  0.28  0.08  1.0
  O  O7  1  0.24  0.37  0.04  1.0
  O  O8  1  0.27  0.6  0.13  1.0
  O  O9  1  0.3  0.88  0.79  1.0
  O  O10  1  0.52  0.76  0.63  1.0
  O  O11  1  0.57  0.35  0.02  1.0
  O  O12  1  0.58  0.01  0.18  1.0
  O  O13  1  0.6  0.14  0.78  1.0
  O  O14  1  0.63  0.72  0.39  1.0
  O  O15  1  0.68  0.68  0.09  1.0
  O  O16  1  0.9  0.46  0.64  1.0
  O  O17  1  0.96  0.95  0.35  1.0
  O  O18  1  0.97  0.75  0.16  1.0

Li Li Nb Nb Nb Nb Zn O O O O O O O O O O O O