data_[Sr8As1Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  As  2.1800  1.1500  0.6600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.7985]
_cell_length_b [8.1813]
_cell_length_c [8.7200]
_cell_angle_alpha [102.4079]
_cell_angle_beta [90.9400]
_cell_angle_gamma [98.1601]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Sr8AsPd2]
_chemical_formula_sum '[Sr8 As1 Pd2]'
_cell_volume [468.3364]
_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  0.1972  0.8078  0.7072  1
  Sr  Sr1  2  0.2356  0.8589  0.2328  1
  Sr  Sr2  2  0.2678  0.3458  0.0772  1
  Sr  Sr3  2  0.3139  0.3325  0.5828  1
  As  As4  1  0.0000  0.0000  0.0000  1
  Pd  Pd5  2  0.1306  0.5473  0.3848  1
]