# generated using pymatgen
data_Y10PPb6Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.13713915
_cell_length_b   9.13713923
_cell_length_c   6.84275540
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000681
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y10PPb6Br
_chemical_formula_sum   'Y10 P1 Pb6 Br1'
_cell_volume   494.74578101
_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
  Y  Y0  1  0.74994792  0.74994792  0.72995435  1.0
  Y  Y1  1  0.25005208  0.00000000  0.72995435  1.0
  Y  Y2  1  0.00000000  0.25005208  0.72995435  1.0
  Y  Y3  1  0.25005208  0.25005208  0.27004565  1.0
  Y  Y4  1  0.74994792  1.00000000  0.27004565  1.0
  Y  Y5  1  1.00000000  0.74994792  0.27004565  1.0
  Y  Y6  1  0.66666700  0.33333300  0.00000000  1.0
  Y  Y7  1  0.33333300  0.66666700  0.00000000  1.0
  Y  Y8  1  0.33333300  0.66666700  0.50000000  1.0
  Y  Y9  1  0.66666700  0.33333300  0.50000000  1.0
  P  P10  1  0.00000000  0.00000000  0.50000000  1.0
  Pb  Pb11  1  0.39572490  0.39572490  0.75102568  1.0
  Pb  Pb12  1  0.60427510  0.00000000  0.75102568  1.0
  Pb  Pb13  1  0.00000000  0.60427510  0.75102568  1.0
  Pb  Pb14  1  0.60427510  0.60427510  0.24897432  1.0
  Pb  Pb15  1  0.39572490  1.00000000  0.24897432  1.0
  Pb  Pb16  1  1.00000000  0.39572490  0.24897432  1.0
  Br  Br17  1  0.00000000  0.00000000  0.00000000  1.0