data_GaOsRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07
_cell_length_b   5.07
_cell_length_c   5.07
_cell_angle_alpha   146.33
_cell_angle_beta   128.16
_cell_angle_gamma   63.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaOsRu2
_chemical_formula_sum   'Ga1 Os1 Ru2'
_cell_volume   56.19
_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
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Os  Os1  1  0.0  0.0  0.32  1.0
  Ru  Ru2  1  0.47  0.0  0.01  1.0
  Ru  Ru3  1  0.0  0.22  0.3  1.0

data_GaOsRu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.94
_cell_length_b   4.43
_cell_length_c   5.07
_cell_angle_alpha   115.92
_cell_angle_beta   106.83
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaOsRu2
_chemical_formula_sum   'Ga1 Os1 Ru2'
_cell_volume   56.19
_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
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Ru  Ru1  1  0.46  0.99  0.46  1.0
  Os  Os2  1  0.68  0.68  0.68  1.0
  Ru  Ru3  1  0.7  0.91  0.91  1.0

Ga Os Ru Ru
Ga Os Ru Ru 0 3 o o o 0 2 o o o 0 2 - o o 1 3 o o o 1 2 - o o 2 3 + o o 