data_TaAsRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.65
_cell_length_b   4.65
_cell_length_c   4.65
_cell_angle_alpha   142.52
_cell_angle_beta   127.3
_cell_angle_gamma   66.45
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAsRu
_chemical_formula_sum   'Ta1 As1 Ru1'
_cell_volume   48.08
_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
  Ta  Ta2  1  0.0  0.0  0.58  1.0
  As  As0  1  0.0  0.0  0.78  1.0
  Ru  Ru1  1  0.0  0.0  0.21  1.0

data_TaAsRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.99
_cell_length_b   4.13
_cell_length_c   4.65
_cell_angle_alpha   116.35
_cell_angle_beta   108.74
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAsRu
_chemical_formula_sum   'Ta1 As1 Ru1'
_cell_volume   48.08
_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
  Ta  Ta0  1  0.0  0.58  0.58  1.0
  As  As1  1  0.0  0.78  0.78  1.0
  Ru  Ru2  1  0.0  0.21  0.21  1.0

Ta As Ru