# generated using pymatgen
data_Er4ReBr4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.81433964
_cell_length_b   8.81433957
_cell_length_c   6.53725277
_cell_angle_alpha   89.19005175
_cell_angle_beta   89.19005617
_cell_angle_gamma   89.07834885
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er4ReBr4
_chemical_formula_sum   'Er8 Re2 Br8'
_cell_volume   507.73046428
_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
  Er  Er0  1  0.24860256  0.90083517  0.01310566  1.0
  Er  Er1  1  0.75139744  0.09916483  0.98689434  1.0
  Er  Er2  1  0.09916483  0.75139744  0.48689434  1.0
  Er  Er3  1  0.90083517  0.24860256  0.51310566  1.0
  Er  Er4  1  0.75228838  0.90286739  0.50955482  1.0
  Er  Er5  1  0.24771162  0.09713261  0.49044518  1.0
  Er  Er6  1  0.09713261  0.24771162  0.99044518  1.0
  Er  Er7  1  0.90286739  0.75228838  0.00955482  1.0
  Re  Re8  1  0.99382430  0.00617570  0.25000000  1.0
  Re  Re9  1  0.00617570  0.99382430  0.75000000  1.0
  Br  Br10  1  0.42166761  0.81466755  0.41377648  1.0
  Br  Br11  1  0.57833239  0.18533245  0.58622352  1.0
  Br  Br12  1  0.18533245  0.57833239  0.08622352  1.0
  Br  Br13  1  0.81466755  0.42166761  0.91377648  1.0
  Br  Br14  1  0.41653718  0.19034885  0.08894251  1.0
  Br  Br15  1  0.58346282  0.80965115  0.91105749  1.0
  Br  Br16  1  0.80965115  0.58346282  0.41105749  1.0
  Br  Br17  1  0.19034885  0.41653718  0.58894251  1.0