data_NaReTc2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.34
_cell_length_b   5.34
_cell_length_c   5.34
_cell_angle_alpha   147.9
_cell_angle_beta   128.84
_cell_angle_gamma   61.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaReTc2
_chemical_formula_sum   'Na1 Re1 Tc2'
_cell_volume   62.52
_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  0.0  0.0  0.59  1.0
  Re  Re1  1  0.48  0.0  0.1  1.0
  Tc  Tc2  1  0.0  0.0  0.01  1.0
  Tc  Tc3  1  0.0  0.31  0.47  1.0

data_NaReTc2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.95
_cell_length_b   4.61
_cell_length_c   5.34
_cell_angle_alpha   115.58
_cell_angle_beta   106.05
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaReTc2
_chemical_formula_sum   'Na1 Re1 Tc2'
_cell_volume   62.52
_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  0.41  0.41  0.41  1.0
  Re  Re1  1  0.38  0.9  0.38  1.0
  Tc  Tc2  1  0.53  0.84  0.84  1.0
  Tc  Tc3  1  0.99  0.99  0.99  1.0

Na Re Tc Tc