data_[Sr1Ho2Ru1O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ho  1.2300  1.7500  1.0410
  Ru  2.2000  1.3000  0.6610
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.3266]
_cell_length_b [5.1098]
_cell_length_c [6.9860]
_cell_angle_alpha [89.0843]
_cell_angle_beta [73.5473]
_cell_angle_gamma [88.0169]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [SrHo2RuO8]
_chemical_formula_sum '[Sr1 Ho2 Ru1 O8]'
_cell_volume [148.0303]
_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  0.0000  0.0000  0.5000  1
  Ho  Ho1  2  0.3921  0.5192  0.7854  1
  Ru  Ru2  1  0.0000  0.0000  0.0000  1
  O  O3  2  0.1689  0.3103  0.0948  1
  O  O4  2  0.2252  0.7806  0.1280  1
  O  O5  2  0.2385  0.4967  0.5067  1
  O  O6  2  0.3507  0.9780  0.7509  1
]