data_MgSbRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13
_cell_length_b   5.13
_cell_length_c   5.13
_cell_angle_alpha   141.99
_cell_angle_beta   139.01
_cell_angle_gamma   57.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSbRu
_chemical_formula_sum   'Mg1 Sb1 Ru1'
_cell_volume   54.03
_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
  Mg  Mg0  1  0.0  0.0  0.04  1.0
  Sb  Sb2  1  0.0  0.0  0.86  1.0
  Ru  Ru1  1  0.0  0.0  0.11  1.0

data_MgSbRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.34
_cell_length_b   3.59
_cell_length_c   5.13
_cell_angle_alpha   110.5
_cell_angle_beta   109.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSbRu
_chemical_formula_sum   'Mg1 Sb1 Ru1'
_cell_volume   54.03
_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
  Mg  Mg0  1  0.0  0.04  0.04  1.0
  Sb  Sb1  1  0.0  0.86  0.86  1.0
  Ru  Ru2  1  0.0  0.11  0.11  1.0

Mg Sb Ru