# generated using pymatgen
data_YbTh(Fe4B)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.11610085
_cell_length_b   5.11610126
_cell_length_c   6.97930441
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001034
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbTh(Fe4B)2
_chemical_formula_sum   'Yb1 Th1 Fe8 B2'
_cell_volume   158.20527350
_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
  Yb  Yb0  1  0.00000000  0.00000000  0.50000000  1.0
  Th  Th1  1  0.00000000  0.00000000  0.00000000  1.0
  Fe  Fe2  1  0.66666700  0.33333300  0.00000000  1.0
  Fe  Fe3  1  0.33333300  0.66666700  0.00000000  1.0
  Fe  Fe4  1  0.50000000  0.50000000  0.70864509  1.0
  Fe  Fe5  1  0.50000000  0.00000000  0.70864509  1.0
  Fe  Fe6  1  0.00000000  0.50000000  0.70864509  1.0
  Fe  Fe7  1  0.50000000  0.50000000  0.29135491  1.0
  Fe  Fe8  1  0.50000000  0.00000000  0.29135491  1.0
  Fe  Fe9  1  0.00000000  0.50000000  0.29135491  1.0
  B  B10  1  0.66666700  0.33333300  0.50000000  1.0
  B  B11  1  0.33333300  0.66666700  0.50000000  1.0