data_[Sr24Ti8P24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ti  1.5400  1.4000  0.8517
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [18.5550]
_cell_length_b [6.6255]
_cell_length_c [12.4861]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Sr3TiP3]
_chemical_formula_sum '[Sr24 Ti8 P24]'
_cell_volume [1535.0010]
_cell_formula_units_Z [8]
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  16  0.1756  0.1773  0.6339  1
  Sr  Sr1  8  0.0000  0.1624  0.3408  1
  Ti  Ti2  8  0.0833  0.0000  0.0000  1
  P  P3  16  0.1581  0.1998  0.8815  1
  P  P4  8  0.0000  0.2175  0.0976  1
]