# generated using pymatgen
data_PaSiHRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.10614905
_cell_length_b   4.10614905
_cell_length_c   6.86097013
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PaSiHRu
_chemical_formula_sum   'Pa2 Si2 H2 Ru2'
_cell_volume   115.67911269
_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
  Pa  Pa0  1  0.50000000  0.00000000  0.67682632  1.0
  Pa  Pa1  1  0.00000000  0.50000000  0.32317368  1.0
  Si  Si2  1  0.50000000  0.00000000  0.18665410  1.0
  Si  Si3  1  0.00000000  0.50000000  0.81334590  1.0
  H  H4  1  0.00000000  0.00000000  0.50000000  1.0
  H  H5  1  0.50000000  0.50000000  0.50000000  1.0
  Ru  Ru6  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru7  1  0.50000000  0.50000000  0.00000000  1.0