data_NaMnRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.43
_cell_length_b   4.43
_cell_length_c   2.52
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaMnRu
_chemical_formula_sum   'Na1 Mn1 Ru1'
_cell_volume   42.66
_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
  Na  Na1  1  0.0  0.0  0.82  1.0
  Mn  Mn0  1  1.0  0.55  0.4  1.0
  Ru  Ru2  1  0.21  0.28  0.81  1.0

data_NaMnRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.52
_cell_length_b   4.43
_cell_length_c   4.43
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaMnRu
_chemical_formula_sum   'Na1 Mn1 Ru1'
_cell_volume   42.66
_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
  Na  Na0  1  0.82  0.0  0.0  1.0
  Mn  Mn1  1  0.4  1.0  0.55  1.0
  Ru  Ru2  1  0.81  0.21  0.28  1.0

Na Mn Ru
Na Mn Ru 0 2 o o o 0 1 - - + 0 1 - - o 0 1 - o o 1 2 + o - 1 2 + o o 1 1 o o + 