# generated using pymatgen
data_PrTh(BRu)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.78899066
_cell_length_b   6.00450000
_cell_length_c   5.58851678
_cell_angle_alpha   71.58995964
_cell_angle_beta   57.05378126
_cell_angle_gamma   51.35625384
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrTh(BRu)4
_chemical_formula_sum   'Pr1 Th1 B4 Ru4'
_cell_volume   149.21870183
_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
  Pr  Pr0  1  0.00000000  0.00000000  0.00000000  1.0
  Th  Th1  1  0.25000000  0.25000000  0.25000000  1.0
  B  B2  1  0.31722560  0.68277440  0.31722560  1.0
  B  B3  1  0.68277440  0.31722560  0.68277440  1.0
  B  B4  1  0.56956945  0.93043055  0.56956945  1.0
  B  B5  1  0.93043055  0.56956945  0.93043055  1.0
  Ru  Ru6  1  0.63658407  0.63658407  0.36341593  1.0
  Ru  Ru7  1  0.36341593  0.36341593  0.63658407  1.0
  Ru  Ru8  1  0.61356364  0.61356364  0.88643636  1.0
  Ru  Ru9  1  0.88643636  0.88643636  0.61356364  1.0