# generated using pymatgen
data_Y4PBr6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.99998779
_cell_length_b   13.06028666
_cell_length_c   13.78177536
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y4PBr6
_chemical_formula_sum   'Y8 P2 Br12'
_cell_volume   719.97354941
_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
  Y  Y0  1  0.50000000  0.11765756  0.34249922  1.0
  Y  Y1  1  0.50000000  0.88234244  0.65750078  1.0
  Y  Y2  1  0.50000000  0.61765756  0.15750078  1.0
  Y  Y3  1  0.50000000  0.38234244  0.84249922  1.0
  Y  Y4  1  0.00000000  0.11497213  0.57686620  1.0
  Y  Y5  1  0.00000000  0.88502787  0.42313380  1.0
  Y  Y6  1  0.00000000  0.61497213  0.92313380  1.0
  Y  Y7  1  0.00000000  0.38502787  0.07686620  1.0
  P  P8  1  0.50000000  0.00000000  0.50000000  1.0
  P  P9  1  0.50000000  0.50000000  0.00000000  1.0
  Br  Br10  1  0.50000000  0.24469464  0.16431836  1.0
  Br  Br11  1  0.50000000  0.75530536  0.83568164  1.0
  Br  Br12  1  0.50000000  0.74469464  0.33568164  1.0
  Br  Br13  1  0.50000000  0.25530536  0.66431836  1.0
  Br  Br14  1  0.00000000  0.25697246  0.41276423  1.0
  Br  Br15  1  0.00000000  0.74302754  0.58723577  1.0
  Br  Br16  1  0.00000000  0.75697246  0.08723577  1.0
  Br  Br17  1  0.00000000  0.24302754  0.91276423  1.0
  Br  Br18  1  0.00000000  0.00058766  0.24140789  1.0
  Br  Br19  1  0.00000000  0.99941234  0.75859211  1.0
  Br  Br20  1  0.00000000  0.50058766  0.25859211  1.0
  Br  Br21  1  0.00000000  0.49941234  0.74140789  1.0