# generated using pymatgen
data_YbBF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.68422619
_cell_length_b   6.68422619
_cell_length_c   4.23524760
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbBF5
_chemical_formula_sum   'Yb2 B2 F10'
_cell_volume   189.22611808
_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
  Yb  Yb0  1  0.50000000  0.00000000  0.76884433  1.0
  Yb  Yb1  1  0.00000000  0.50000000  0.23115567  1.0
  B  B2  1  0.00000000  0.00000000  0.00000000  1.0
  B  B3  1  0.50000000  0.50000000  0.00000000  1.0
  F  F4  1  0.00000000  0.50000000  0.72929805  1.0
  F  F5  1  0.50000000  0.00000000  0.27070195  1.0
  F  F6  1  0.52718516  0.66903563  0.80788456  1.0
  F  F7  1  0.83096437  0.02718516  0.80788456  1.0
  F  F8  1  0.33096437  0.52718516  0.19211544  1.0
  F  F9  1  0.02718516  0.16903563  0.19211544  1.0
  F  F10  1  0.97281484  0.83096437  0.19211544  1.0
  F  F11  1  0.66903563  0.47281484  0.19211544  1.0
  F  F12  1  0.16903563  0.97281484  0.80788456  1.0
  F  F13  1  0.47281484  0.33096437  0.80788456  1.0