# generated using pymatgen
data_BaIO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.46946700
_cell_length_b   6.98332173
_cell_length_c   7.62397433
_cell_angle_alpha   79.88605008
_cell_angle_beta   88.80990323
_cell_angle_gamma   87.81212242
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaIO5
_chemical_formula_sum   'Ba2 I2 O10'
_cell_volume   286.43471484
_cell_formula_units_Z   2
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
  Ba  Ba0  1  0.79068000  0.29133900  0.93017300  1.0
  Ba  Ba1  1  0.20932000  0.70866100  0.06982700  1.0
  I  I2  1  0.80972200  0.31046400  0.41837600  1.0
  I  I3  1  0.19027800  0.68953600  0.58162400  1.0
  O  O4  1  0.77803800  0.81926300  0.82813500  1.0
  O  O5  1  0.22196200  0.18073700  0.17186500  1.0
  O  O6  1  0.61536300  0.68638900  0.83773400  1.0
  O  O7  1  0.38463700  0.31361100  0.16226600  1.0
  O  O8  1  0.83932500  0.49815300  0.19851600  1.0
  O  O9  1  0.16067500  0.50184700  0.80148400  1.0
  O  O10  1  0.79956300  0.94854100  0.20034600  1.0
  O  O11  1  0.20043700  0.05145900  0.79965400  1.0
  O  O12  1  0.41527200  0.12042800  0.78274100  1.0
  O  O13  1  0.58472800  0.87957200  0.21725900  1.0