data_ZrRhW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.26
_cell_length_b   5.26
_cell_length_c   5.26
_cell_angle_alpha   143.25
_cell_angle_beta   127.24
_cell_angle_gamma   66.02
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrRhW2
_chemical_formula_sum   'Zr1 Rh1 W2'
_cell_volume   68.48
_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
  Zr  Zr3  1  0.0  0.0  0.42  1.0
  Rh  Rh0  1  0.0  0.34  0.27  1.0
  W  W1  1  0.0  0.0  0.06  1.0
  W  W2  1  0.66  0.0  0.08  1.0

data_ZrRhW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.32
_cell_length_b   4.68
_cell_length_c   5.26
_cell_angle_alpha   116.38
_cell_angle_beta   108.38
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrRhW2
_chemical_formula_sum   'Zr1 Rh1 W2'
_cell_volume   68.48
_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
  Zr  Zr0  1  0.0  0.42  0.42  1.0
  Rh  Rh1  1  0.66  0.93  0.93  1.0
  W  W2  1  0.0  0.06  0.06  1.0
  W  W3  1  0.0  0.08  0.42  1.0

Zr Rh W W
Zr Rh W W 0 3 - o o 0 2 o o o 1 2 o o o 2 3 - o o 