data_[Sr1La1Re2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  La  1.1000  1.9500  1.1720
  Re  1.9000  1.3500  0.7125
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [3.1625]
_cell_length_b [4.0568]
_cell_length_c [8.5740]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.6754]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [SrLaRe2]
_chemical_formula_sum '[Sr1 La1 Re2]'
_cell_volume [109.9550]
_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
[
  Sr  Sr0  1  0.8706  0.0000  0.4264  1
  La  La1  1  0.6368  0.5000  0.8414  1
  Re  Re2  1  0.0637  0.0000  0.0712  1
  Re  Re3  1  0.4289  0.5000  0.1611  1
]