data_As2PRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.11
_cell_length_b   6.11
_cell_length_c   4.05
_cell_angle_alpha   98.58
_cell_angle_beta   98.58
_cell_angle_gamma   28.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   As2PRu
_chemical_formula_sum   'As2 P1 Ru1'
_cell_volume   70.53
_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
  As  As0  1  0.62  0.0  0.92  1.0
  As  As1  1  0.6  0.0  0.09  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  Ru  Ru3  1  0.61  0.0  0.0  1.0

data_As2PRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.97
_cell_length_b   4.05
_cell_length_c   6.11
_cell_angle_alpha   98.58
_cell_angle_beta   104.09
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   As2PRu
_chemical_formula_sum   'As2 P1 Ru1'
_cell_volume   70.53
_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
  As  As0  1  0.0  0.09  0.6  1.0
  As  As1  1  0.0  0.92  0.62  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  Ru  Ru3  1  0.0  0.0  0.61  1.0

As As P Ru