data_AsRu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.51
_cell_length_b   5.51
_cell_length_c   13.12
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AsRu3
_chemical_formula_sum   'As6 Ru18'
_cell_volume   344.76
_cell_formula_units_Z   6
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
  As  As0  1  0.0  0.0  0.28  1.0
  As  As1  1  0.0  0.0  0.84  1.0
  As  As2  1  0.75  0.59  0.3  1.0
  As  As3  1  0.75  0.59  0.38  1.0
  As  As4  1  0.0  0.18  0.74  1.0
  As  As5  1  0.0  0.18  0.82  1.0
  Ru  Ru6  1  0.0  0.69  0.28  1.0
  Ru  Ru7  1  0.69  0.43  0.28  1.0
  Ru  Ru8  1  0.31  0.43  0.28  1.0
  Ru  Ru9  1  0.75  0.08  0.84  1.0
  Ru  Ru10  1  0.06  0.34  0.84  1.0
  Ru  Ru11  1  0.45  0.34  0.84  1.0
  Ru  Ru12  1  0.75  0.19  0.38  1.0
  Ru  Ru13  1  0.37  0.79  0.38  1.0
  Ru  Ru14  1  0.14  0.79  0.38  1.0
  Ru  Ru15  1  0.75  0.19  0.18  1.0
  Ru  Ru16  1  0.37  0.79  0.18  1.0
  Ru  Ru17  1  0.14  0.79  0.18  1.0
  Ru  Ru18  1  0.0  0.58  0.74  1.0
  Ru  Ru19  1  0.39  0.98  0.74  1.0
  Ru  Ru20  1  0.61  0.98  0.74  1.0
  Ru  Ru21  1  0.0  0.58  0.94  1.0
  Ru  Ru22  1  0.39  0.98  0.94  1.0
  Ru  Ru23  1  0.61  0.98  0.94  1.0

data_AsRu3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.51
_cell_length_b   5.51
_cell_length_c   13.12
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AsRu3
_chemical_formula_sum   'As6 Ru18'
_cell_volume   344.76
_cell_formula_units_Z   6
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
  As  As0  1  0.0  0.0  0.28  1.0
  As  As1  1  0.0  0.0  0.84  1.0
  As  As2  1  0.0  0.18  0.74  1.0
  As  As3  1  0.0  0.18  0.82  1.0
  As  As4  1  0.75  0.59  0.3  1.0
  As  As5  1  0.75  0.59  0.38  1.0
  Ru  Ru6  1  0.0  0.58  0.74  1.0
  Ru  Ru7  1  0.0  0.58  0.94  1.0
  Ru  Ru8  1  0.0  0.69  0.28  1.0
  Ru  Ru9  1  0.06  0.34  0.84  1.0
  Ru  Ru10  1  0.14  0.79  0.18  1.0
  Ru  Ru11  1  0.14  0.79  0.38  1.0
  Ru  Ru12  1  0.31  0.43  0.28  1.0
  Ru  Ru13  1  0.37  0.79  0.18  1.0
  Ru  Ru14  1  0.37  0.79  0.38  1.0
  Ru  Ru15  1  0.39  0.98  0.74  1.0
  Ru  Ru16  1  0.39  0.98  0.94  1.0
  Ru  Ru17  1  0.45  0.34  0.84  1.0
  Ru  Ru18  1  0.61  0.98  0.74  1.0
  Ru  Ru19  1  0.61  0.98  0.94  1.0
  Ru  Ru20  1  0.69  0.43  0.28  1.0
  Ru  Ru21  1  0.75  0.08  0.84  1.0
  Ru  Ru22  1  0.75  0.19  0.18  1.0
  Ru  Ru23  1  0.75  0.19  0.38  1.0

As As As As As As Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru