# generated using pymatgen
data_Tb5BSe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.00989525
_cell_length_b   7.00991052
_cell_length_c   7.00990540
_cell_angle_alpha   99.55047169
_cell_angle_beta   99.55026809
_cell_angle_gamma   131.92606733
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb5BSe4
_chemical_formula_sum   'Tb5 B1 Se4'
_cell_volume   234.05545356
_cell_formula_units_Z   1
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  0.40811141  0.77019692  0.17830733  1.0
  Tb  Tb1  1  0.00000000  0.00000000  0.00000000  1.0
  Tb  Tb2  1  0.59188859  0.22980308  0.82169267  1.0
  Tb  Tb3  1  0.22980308  0.40811041  0.63791548  1.0
  Tb  Tb4  1  0.77019692  0.59188959  0.36208452  1.0
  B  B5  1  0.50000000  0.50000000  0.00000000  1.0
  Se  Se6  1  0.09320496  0.69577466  0.78897962  1.0
  Se  Se7  1  0.69577366  0.90679504  0.60256970  1.0
  Se  Se8  1  0.30422634  0.09320496  0.39743030  1.0
  Se  Se9  1  0.90679504  0.30422534  0.21102038  1.0