# generated using pymatgen
data_PaNiAsH
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.95583694
_cell_length_b   8.17251515
_cell_length_c   6.96201476
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PaNiAsH
_chemical_formula_sum   'Pa4 Ni4 As4 H4'
_cell_volume   225.07593107
_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  0.75000000  0.50572365  0.75818585  1.0
  Pa  Pa1  1  0.25000000  0.49427635  0.24181415  1.0
  Pa  Pa2  1  0.25000000  0.99427635  0.25818585  1.0
  Pa  Pa3  1  0.75000000  0.00572365  0.74181415  1.0
  Ni  Ni4  1  0.75000000  0.25532455  0.41219013  1.0
  Ni  Ni5  1  0.25000000  0.74467545  0.58780987  1.0
  Ni  Ni6  1  0.25000000  0.24467545  0.91219013  1.0
  Ni  Ni7  1  0.75000000  0.75532455  0.08780987  1.0
  As  As8  1  0.75000000  0.22564045  0.08174800  1.0
  As  As9  1  0.25000000  0.77435955  0.91825200  1.0
  As  As10  1  0.25000000  0.27435955  0.58174800  1.0
  As  As11  1  0.75000000  0.72564045  0.41825200  1.0
  H  H12  1  0.25000000  0.95090241  0.57773067  1.0
  H  H13  1  0.75000000  0.04909759  0.42226933  1.0
  H  H14  1  0.75000000  0.54909759  0.07773067  1.0
  H  H15  1  0.25000000  0.45090241  0.92226933  1.0