# generated using pymatgen
data_Tb4BBr6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.66271974
_cell_length_b   10.66276247
_cell_length_c   12.62052334
_cell_angle_alpha   84.32806647
_cell_angle_beta   84.32670670
_cell_angle_gamma   63.66562611
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb4BBr6
_chemical_formula_sum   'Tb16 B4 Br24'
_cell_volume   1277.23444372
_cell_formula_units_Z   4
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  0.71329004  0.47065748  0.19154338  1.0
  Tb  Tb1  1  0.52934958  0.28672451  0.30847883  1.0
  Tb  Tb2  1  0.28672470  0.52935022  0.80845442  1.0
  Tb  Tb3  1  0.47065057  0.71326728  0.69152212  1.0
  Tb  Tb4  1  0.78549534  0.54511554  0.45404420  1.0
  Tb  Tb5  1  0.45488082  0.21451635  0.04597678  1.0
  Tb  Tb6  1  0.21451941  0.45487845  0.54596709  1.0
  Tb  Tb7  1  0.54510156  0.78549392  0.95400923  1.0
  Tb  Tb8  1  0.58142441  0.35795758  0.58873599  1.0
  Tb  Tb9  1  0.64202119  0.41856064  0.91126525  1.0
  Tb  Tb10  1  0.41857003  0.64203687  0.41127279  1.0
  Tb  Tb11  1  0.35795562  0.58143955  0.08871616  1.0
  Tb  Tb12  1  0.11471531  0.81309411  0.60506463  1.0
  Tb  Tb13  1  0.18690324  0.88527585  0.89492641  1.0
  Tb  Tb14  1  0.88530333  0.18689937  0.39494166  1.0
  Tb  Tb15  1  0.81310030  0.11471768  0.10506465  1.0
  B  B16  1  0.66212288  0.41194674  0.39493894  1.0
  B  B17  1  0.58804229  0.33790102  0.10506260  1.0
  B  B18  1  0.33789046  0.58805200  0.60506055  1.0
  B  B19  1  0.41195455  0.66209803  0.89493418  1.0
  Br  Br20  1  0.14085869  0.37586734  0.74813037  1.0
  Br  Br21  1  0.62414416  0.85913993  0.75186073  1.0
  Br  Br22  1  0.85913552  0.62416193  0.25187633  1.0
  Br  Br23  1  0.37582846  0.14088246  0.24813284  1.0
  Br  Br24  1  0.15848927  0.91407678  0.39524652  1.0
  Br  Br25  1  0.08592273  0.84149520  0.10474196  1.0
  Br  Br26  1  0.84151158  0.08592246  0.60474944  1.0
  Br  Br27  1  0.91410810  0.15849109  0.89526733  1.0
  Br  Br28  1  0.05451467  0.30702545  0.46606701  1.0
  Br  Br29  1  0.69296823  0.94549795  0.03400017  1.0
  Br  Br30  1  0.94551259  0.69296517  0.53391802  1.0
  Br  Br31  1  0.30702967  0.05450546  0.96604292  1.0
  Br  Br32  1  0.98705702  0.22533447  0.18015881  1.0
  Br  Br33  1  0.77467653  0.01295211  0.31983688  1.0
  Br  Br34  1  0.01293528  0.77468598  0.81983518  1.0
  Br  Br35  1  0.22534324  0.98704443  0.68015720  1.0
  Br  Br36  1  0.47035987  0.74894475  0.18439982  1.0
  Br  Br37  1  0.25104779  0.52964983  0.31558184  1.0
  Br  Br38  1  0.52963422  0.25105882  0.81559170  1.0
  Br  Br39  1  0.74894369  0.47035494  0.68442220  1.0
  Br  Br40  1  0.80897814  0.54664014  0.97375712  1.0
  Br  Br41  1  0.45334630  0.19096201  0.52625144  1.0
  Br  Br42  1  0.19099072  0.45335428  0.02623538  1.0
  Br  Br43  1  0.54664693  0.80900283  0.47376092  1.0