# generated using pymatgen
data_PaB4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.09961285
_cell_length_b   7.09961285
_cell_length_c   4.00343911
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PaB4
_chemical_formula_sum   'Pa4 B16'
_cell_volume   201.79135742
_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
  Pa  Pa0  1  0.81019238  0.31019238  0.00000000  1.0
  Pa  Pa1  1  0.18980762  0.68980762  0.00000000  1.0
  Pa  Pa2  1  0.31019238  0.18980762  0.00000000  1.0
  Pa  Pa3  1  0.68980762  0.81019238  0.00000000  1.0
  B  B4  1  0.50000000  0.50000000  0.80084252  1.0
  B  B5  1  0.00000000  0.00000000  0.80084252  1.0
  B  B6  1  0.50000000  0.50000000  0.19915748  1.0
  B  B7  1  0.00000000  0.00000000  0.19915748  1.0
  B  B8  1  0.58808118  0.08808118  0.50000000  1.0
  B  B9  1  0.41191882  0.91191882  0.50000000  1.0
  B  B10  1  0.08808118  0.41191882  0.50000000  1.0
  B  B11  1  0.91191882  0.58808118  0.50000000  1.0
  B  B12  1  0.67774246  0.53848136  0.50000000  1.0
  B  B13  1  0.32225754  0.46151864  0.50000000  1.0
  B  B14  1  0.17774246  0.96151864  0.50000000  1.0
  B  B15  1  0.82225754  0.03848136  0.50000000  1.0
  B  B16  1  0.46151864  0.67774246  0.50000000  1.0
  B  B17  1  0.53848136  0.32225754  0.50000000  1.0
  B  B18  1  0.03848136  0.17774246  0.50000000  1.0
  B  B19  1  0.96151864  0.82225754  0.50000000  1.0