data_Na5MnO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.75
_cell_length_b   5.98
_cell_length_c   5.79
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na5MnO4
_chemical_formula_sum   'Na10 Mn2 O8'
_cell_volume   268.31
_cell_formula_units_Z   2
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
  Na  Na2  1  0.39  0.55  0.53  1.0
  Na  Na3  1  0.37  0.55  0.53  1.0
  Na  Na4  1  0.88  0.05  0.38  1.0
  Na  Na5  1  0.34  0.63  0.32  1.0
  Na  Na6  1  0.41  0.63  0.32  1.0
  Na  Na7  1  0.53  0.35  0.43  1.0
  Na  Na8  1  0.22  0.35  0.43  1.0
  Na  Na9  1  0.0  0.93  0.28  1.0
  Na  Na10  1  0.49  0.43  0.42  1.0
  Na  Na11  1  0.26  0.43  0.42  1.0
  Mn  Mn0  1  0.0  0.95  0.75  1.0
  Mn  Mn1  1  0.88  0.03  0.86  1.0
  O  O12  1  0.88  0.21  0.56  1.0
  O  O13  1  0.76  0.44  0.55  1.0
  O  O14  1  1.0  0.44  0.55  1.0
  O  O15  1  0.0  0.27  0.96  1.0
  O  O16  1  0.88  0.71  0.07  1.0
  O  O17  1  0.12  0.54  0.45  1.0
  O  O18  1  0.63  0.54  0.45  1.0
  O  O19  1  0.0  0.77  0.67  1.0

data_Na5MnO4
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.79
_cell_length_b   5.98
_cell_length_c   7.75
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na5MnO4
_chemical_formula_sum   'Na10 Mn2 O8'
_cell_volume   268.31
_cell_formula_units_Z   2
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
  Na  Na0  1  0.47  0.45  0.61  1.0
  Na  Na1  1  0.47  0.45  0.63  1.0
  Na  Na2  1  0.57  0.65  0.47  1.0
  Na  Na3  1  0.57  0.65  0.78  1.0
  Na  Na4  1  0.58  0.57  0.51  1.0
  Na  Na5  1  0.58  0.57  0.74  1.0
  Na  Na6  1  0.62  0.95  0.12  1.0
  Na  Na7  1  0.68  0.37  0.59  1.0
  Na  Na8  1  0.68  0.37  0.66  1.0
  Na  Na9  1  0.72  0.07  0.0  1.0
  Mn  Mn10  1  0.14  0.97  0.12  1.0
  Mn  Mn11  1  0.25  0.05  0.0  1.0
  O  O12  1  0.04  0.73  0.0  1.0
  O  O13  1  0.33  0.23  0.0  1.0
  O  O14  1  0.44  0.79  0.12  1.0
  O  O15  1  0.45  0.56  0.0  1.0
  O  O16  1  0.45  0.56  0.24  1.0
  O  O17  1  0.55  0.46  0.37  1.0
  O  O18  1  0.55  0.46  0.88  1.0
  O  O19  1  0.93  0.29  0.12  1.0

Na Na Na Na Na Na Na Na Na Na Mn Mn O O O O O O O O