# generated using pymatgen
data_La3Y2Hg3Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.47183637
_cell_length_b   9.47183584
_cell_length_c   6.71682447
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000184
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3Y2Hg3Br
_chemical_formula_sum   'La6 Y4 Hg6 Br2'
_cell_volume   521.87076946
_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
  La  La0  1  0.27578693  0.27578693  0.75000000  1.0
  La  La1  1  1.00000000  0.72421307  0.75000000  1.0
  La  La2  1  0.72421307  0.00000000  0.75000000  1.0
  La  La3  1  0.00000000  0.27578693  0.25000000  1.0
  La  La4  1  0.72421307  0.72421307  0.25000000  1.0
  La  La5  1  0.27578693  0.00000000  0.25000000  1.0
  Y  Y6  1  0.33333300  0.66666700  0.50000000  1.0
  Y  Y7  1  0.66666700  0.33333300  0.50000000  1.0
  Y  Y8  1  0.33333300  0.66666700  0.00000000  1.0
  Y  Y9  1  0.66666700  0.33333300  0.00000000  1.0
  Hg  Hg10  1  0.60601192  0.00000000  0.25000000  1.0
  Hg  Hg11  1  0.00000000  0.39398808  0.75000000  1.0
  Hg  Hg12  1  0.39398808  0.00000000  0.75000000  1.0
  Hg  Hg13  1  0.60601192  0.60601192  0.75000000  1.0
  Hg  Hg14  1  1.00000000  0.60601192  0.25000000  1.0
  Hg  Hg15  1  0.39398808  0.39398808  0.25000000  1.0
  Br  Br16  1  0.00000000  0.00000000  0.00000000  1.0
  Br  Br17  1  0.00000000  0.00000000  0.50000000  1.0