# generated using pymatgen
data_Tb6SiBBr6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.95501643
_cell_length_b   9.95501651
_cell_length_c   9.84466536
_cell_angle_alpha   109.48247589
_cell_angle_beta   109.48248218
_cell_angle_gamma   109.89861608
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb6SiBBr6
_chemical_formula_sum   'Tb12 Si2 B2 Br12'
_cell_volume   746.83083110
_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  0.25958801  0.00958801  0.01917702  1.0
  Tb  Tb1  1  0.03062252  0.27177686  0.00484222  1.0
  Tb  Tb2  1  0.47422070  0.73306436  0.00484222  1.0
  Tb  Tb3  1  0.76893476  0.24244670  0.27645437  1.0
  Tb  Tb4  1  0.00751962  0.03400767  0.27645437  1.0
  Tb  Tb5  1  0.02120541  0.47879459  0.75000000  1.0
  Tb  Tb6  1  0.22879459  0.27120541  0.75000000  1.0
  Tb  Tb7  1  0.25755330  0.73106524  0.22354563  1.0
  Tb  Tb8  1  0.22822314  0.46937748  0.49515778  1.0
  Tb  Tb9  1  0.46599233  0.49248038  0.22354563  1.0
  Tb  Tb10  1  0.76693564  0.02577930  0.49515778  1.0
  Tb  Tb11  1  0.49041199  0.24041199  0.48082298  1.0
  Si  Si12  1  0.50080919  0.99919081  0.25000000  1.0
  Si  Si13  1  0.24919081  0.25080919  0.25000000  1.0
  B  B14  1  0.00065682  0.25065682  0.50131265  1.0
  B  B15  1  0.24934318  0.49934318  0.99868735  1.0
  Br  Br16  1  0.75697174  0.74302826  0.25000000  1.0
  Br  Br17  1  0.50524453  0.25132337  0.99300102  1.0
  Br  Br18  1  0.24867663  0.99475547  0.50699898  1.0
  Br  Br19  1  0.51521295  0.50786407  0.75939687  1.0
  Br  Br20  1  0.99213593  0.98478705  0.74060313  1.0
  Br  Br21  1  0.74448480  0.99448480  0.98896960  1.0
  Br  Br22  1  0.50551520  0.75551520  0.51103040  1.0
  Br  Br23  1  0.75832335  0.51224251  0.50699898  1.0
  Br  Br24  1  0.99302826  0.50697174  0.25000000  1.0
  Br  Br25  1  0.98775749  0.74167665  0.99300102  1.0
  Br  Br26  1  0.24846720  0.75581708  0.74060313  1.0
  Br  Br27  1  0.74418292  0.25153280  0.75939687  1.0