# generated using pymatgen
data_BaPa(NiAs)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.08670554
_cell_length_b   8.70726729
_cell_length_c   7.05784880
_cell_angle_alpha   90.00966578
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaPa(NiAs)2
_chemical_formula_sum   'Ba2 Pa2 Ni4 As4'
_cell_volume   251.14675267
_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
  Ba  Ba0  1  0.25000000  0.50008787  0.24974327  1.0
  Ba  Ba1  1  0.75000000  0.49991213  0.75025673  1.0
  Pa  Pa2  1  0.75000000  0.99979560  0.74974592  1.0
  Pa  Pa3  1  0.25000000  0.00020440  0.25025408  1.0
  Ni  Ni4  1  0.25000000  0.81430679  0.91761345  1.0
  Ni  Ni5  1  0.75000000  0.18569321  0.08238655  1.0
  Ni  Ni6  1  0.75000000  0.81440714  0.41775523  1.0
  Ni  Ni7  1  0.25000000  0.18559286  0.58224477  1.0
  As  As8  1  0.25000000  0.77325637  0.58394546  1.0
  As  As9  1  0.75000000  0.22674363  0.41605454  1.0
  As  As10  1  0.75000000  0.77408401  0.08402548  1.0
  As  As11  1  0.25000000  0.22591599  0.91597452  1.0