data_BaPRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.01
_cell_length_b   3.62
_cell_length_c   7.21
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaPRu2
_chemical_formula_sum   'Ba1 P1 Ru2'
_cell_volume   78.56
_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
  Ba  Ba0  1  0.51  0.81  0.66  1.0
  P  P1  1  0.0  0.0  0.05  1.0
  Ru  Ru2  1  0.51  0.81  0.11  1.0
  Ru  Ru3  1  0.0  0.0  0.19  1.0

data_BaPRu2
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.62
_cell_length_b   3.01
_cell_length_c   7.21
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   BaPRu2
_chemical_formula_sum   'Ba1 P1 Ru2'
_cell_volume   78.56
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.81  0.0  0.66  1.0
  P  P1  1  0.0  0.5  0.05  1.0
  Ru  Ru2  1  0.0  0.5  0.19  1.0
  Ru  Ru3  1  0.81  0.0  0.11  1.0

Ba P Ru Ru
BaRu2P crystallizes in the triclinic P1 space group. Ba(1) is bonded in a 10-coordinate geometry to four equivalent Ba(1), two equivalent Ru(1), two equivalent Ru(2), and two equivalent P(1) atoms. There are two shorter (3.01 Å) and two longer (3.62 Å) Ba(1)-Ba(1) bond lengths. There is one shorter (3.24 Å) and one longer (3.97 Å) Ba(1)-Ru(1) bond length. There is one shorter (3.79 Å) and one longer (3.80 Å) Ba(1)-Ru(2) bond length. There is one shorter (3.24 Å) and one longer (3.26 Å) Ba(1)-P(1) bond length. There are two inequivalent Ru sites. In the first Ru site, Ru(1) is bonded in a 5-coordinate geometry to two equivalent Ba(1), two equivalent Ru(2), and two equivalent P(1) atoms. There is one shorter (1.73 Å) and one longer (1.77 Å) Ru(1)-Ru(2) bond length. There is one shorter (1.70 Å) and one longer (1.73 Å) Ru(1)-P(1) bond length. In the second Ru site, Ru(2) is bonded in a single-bond geometry to two equivalent Ba(1), two equivalent Ru(1), and one P(1) atom. The Ru(2)-P(1) bond length is 0.99 Å. P(1) is bonded in a distorted single-bond geometry to two equivalent Ba(1), one Ru(2), and two equivalent Ru(1) atoms.