data_[Sr3In1P2Pd9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  In  1.7800  1.5500  0.9400
  P  2.1900  1.0000  0.5500
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.2799]
_cell_length_b [6.2799]
_cell_length_c [9.6193]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Sr3InP2Pd9]
_chemical_formula_sum '[Sr3 In1 P2 Pd9]'
_cell_volume [328.5295]
_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  2  0.3333  0.6667  0.3329  1.0
  Sr  Sr1  1  0.0000  0.0000  0.0000  1.0
  In  In2  1  0.0000  0.0000  0.5000  1.0
  P  P3  2  0.3333  0.6667  0.8425  1.0
  Pd  Pd4  6  0.1517  0.3034  0.7227  1.0
  Pd  Pd5  3  0.0000  0.5000  0.0000  1.0
]