data_[Sr1La2W1]
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
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [3.6517]
_cell_length_b [4.8819]
_cell_length_c [7.9673]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.1866]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [SrLa2W]
_chemical_formula_sum '[Sr1 La2 W1]'
_cell_volume [139.3372]
_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  0.4078  0.0000  0.5321  1
  La  La1  1  0.0095  0.0000  0.9234  1
  La  La2  1  0.7655  0.5000  0.1793  1
  W  W3  1  0.3172  0.5000  0.8652  1
]