data_P2RuSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.43
_cell_length_b   4.43
_cell_length_c   5.02
_cell_angle_alpha   102.41
_cell_angle_beta   102.41
_cell_angle_gamma   42.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P2RuSe
_chemical_formula_sum   'P2 Ru1 Se1'
_cell_volume   64.03
_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
  P  P0  1  0.95  0.0  0.58  1.0
  P  P1  1  0.17  0.0  0.3  1.0
  Ru  Ru2  1  0.56  0.0  0.44  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

data_P2RuSe
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.17
_cell_length_b   4.43
_cell_length_c   5.02
_cell_angle_alpha   102.41
_cell_angle_beta   90.0
_cell_angle_gamma   111.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P2RuSe
_chemical_formula_sum   'P2 Ru1 Se1'
_cell_volume   64.03
_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
  P  P0  1  0.0  0.05  0.42  1.0
  P  P1  1  0.0  0.83  0.7  1.0
  Ru  Ru2  1  0.0  0.44  0.56  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

P P Ru Se