# generated using pymatgen
data_Tb2C2Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.68625604
_cell_length_b   7.68625617
_cell_length_c   6.54802616
_cell_angle_alpha   101.96981846
_cell_angle_beta   101.96981794
_cell_angle_gamma   30.11888625
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb2C2Br
_chemical_formula_sum   'Tb4 C4 Br2'
_cell_volume   189.58869813
_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
  Tb  Tb0  1  0.46690544  0.84676721  0.15868191  1.0
  Tb  Tb1  1  0.15323379  0.53309456  0.34131709  1.0
  Tb  Tb2  1  0.84676721  0.46690544  0.65868291  1.0
  Tb  Tb3  1  0.53309556  0.15323379  0.84131809  1.0
  C  C4  1  0.08423825  0.35605923  0.02817225  1.0
  C  C5  1  0.64394077  0.91576275  0.47182675  1.0
  C  C6  1  0.35605923  0.08423825  0.52817325  1.0
  C  C7  1  0.91576275  0.64394077  0.97182775  1.0
  Br  Br8  1  0.76200540  0.23799460  0.25000000  1.0
  Br  Br9  1  0.23799460  0.76200540  0.75000100  1.0