# generated using pymatgen
data_ErTiO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.30388300
_cell_length_b   5.68893600
_cell_length_c   7.66029400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErTiO3
_chemical_formula_sum   'Er4 Ti4 O12'
_cell_volume   231.13750518
_cell_formula_units_Z   4
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
  Er  Er0  1  0.02306600  0.92605500  0.25000000  1.0
  Er  Er1  1  0.47693400  0.42605500  0.25000000  1.0
  Er  Er2  1  0.52306600  0.57394500  0.75000000  1.0
  Er  Er3  1  0.97693400  0.07394500  0.75000000  1.0
  Ti  Ti4  1  0.00000000  0.50000000  0.50000000  1.0
  Ti  Ti5  1  0.00000000  0.50000000  0.00000000  1.0
  Ti  Ti6  1  0.50000000  0.00000000  0.50000000  1.0
  Ti  Ti7  1  0.50000000  0.00000000  0.00000000  1.0
  O  O8  1  0.12704400  0.45103900  0.75000000  1.0
  O  O9  1  0.18741300  0.19492800  0.06064800  1.0
  O  O10  1  0.18741300  0.19492800  0.43935200  1.0
  O  O11  1  0.31258700  0.69492800  0.06064800  1.0
  O  O12  1  0.31258700  0.69492800  0.43935200  1.0
  O  O13  1  0.37295600  0.95103900  0.75000000  1.0
  O  O14  1  0.62704400  0.04896100  0.25000000  1.0
  O  O15  1  0.68741300  0.30507200  0.56064800  1.0
  O  O16  1  0.68741300  0.30507200  0.93935200  1.0
  O  O17  1  0.81258700  0.80507200  0.56064800  1.0
  O  O18  1  0.81258700  0.80507200  0.93935200  1.0
  O  O19  1  0.87295600  0.54896100  0.25000000  1.0