data_Na3ReO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.37
_cell_length_b   5.37
_cell_length_c   13.13
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na3ReO5
_chemical_formula_sum   'Na9 Re3 O15'
_cell_volume   328.0
_cell_formula_units_Z   3
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  0.14  0.89  0.49  1.0
  Na  Na1  1  0.3  0.28  0.87  1.0
  Na  Na2  1  0.61  0.49  0.11  1.0
  Na  Na3  1  0.61  0.37  0.02  1.0
  Na  Na4  1  0.46  0.76  0.27  1.0
  Na  Na5  1  0.93  0.17  0.64  1.0
  Na  Na6  1  0.7  0.21  0.57  1.0
  Na  Na7  1  0.97  0.0  0.94  1.0
  Na  Na8  1  0.02  0.44  0.19  1.0
  Re  Re24  1  0.07  0.85  0.0  1.0
  Re  Re25  1  0.23  0.0  0.38  1.0
  Re  Re26  1  0.38  0.8  0.75  1.0
  O  O9  1  0.77  0.03  0.25  1.0
  O  O10  1  0.68  0.8  0.63  1.0
  O  O11  1  0.55  0.47  0.87  1.0
  O  O12  1  0.97  0.41  0.0  1.0
  O  O13  1  0.43  0.0  0.38  1.0
  O  O14  1  0.28  0.24  0.75  1.0
  O  O15  1  0.36  0.85  0.26  1.0
  O  O16  1  0.45  0.62  0.51  1.0
  O  O17  1  0.24  0.18  0.88  1.0
  O  O18  1  0.0  0.78  0.83  1.0
  O  O19  1  0.69  0.08  0.21  1.0
  O  O20  1  0.36  0.79  0.45  1.0
  O  O21  1  0.68  0.86  0.3  1.0
  O  O22  1  0.01  0.58  0.68  1.0
  O  O23  1  0.32  0.87  0.92  1.0

data_Na3ReO5
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.37
_cell_length_b   5.37
_cell_length_c   13.13
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na3ReO5
_chemical_formula_sum   'Na9 Re3 O15'
_cell_volume   328.0
_cell_formula_units_Z   3
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  0.02  0.44  0.19  1.0
  Na  Na1  1  0.14  0.89  0.49  1.0
  Na  Na2  1  0.3  0.28  0.87  1.0
  Na  Na3  1  0.46  0.76  0.27  1.0
  Na  Na4  1  0.61  0.49  0.11  1.0
  Na  Na5  1  0.61  0.37  0.02  1.0
  Na  Na6  1  0.7  0.21  0.57  1.0
  Na  Na7  1  0.93  0.17  0.64  1.0
  Na  Na8  1  0.97  0.0  0.94  1.0
  Re  Re9  1  0.07  0.85  -0.0  1.0
  Re  Re10  1  0.23  0.0  0.38  1.0
  Re  Re11  1  0.38  0.8  0.75  1.0
  O  O12  1  0.0  0.78  0.83  1.0
  O  O13  1  0.01  0.58  0.68  1.0
  O  O14  1  0.24  0.18  0.88  1.0
  O  O15  1  0.28  0.24  0.75  1.0
  O  O16  1  0.32  0.87  0.92  1.0
  O  O17  1  0.36  0.79  0.45  1.0
  O  O18  1  0.36  0.85  0.26  1.0
  O  O19  1  0.43  0.0  0.38  1.0
  O  O20  1  0.45  0.62  0.51  1.0
  O  O21  1  0.55  0.47  0.87  1.0
  O  O22  1  0.68  0.86  0.3  1.0
  O  O23  1  0.68  0.8  0.63  1.0
  O  O24  1  0.69  0.08  0.21  1.0
  O  O25  1  0.77  0.03  0.25  1.0
  O  O26  1  0.97  0.41  -0.0  1.0

Na Na Na Na Na Na Na Na Na Re Re Re O O O O O O O O O O O O O O O