data_In2CoAg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.48
_cell_length_b   6.48
_cell_length_c   6.48
_cell_angle_alpha   153.49
_cell_angle_beta   140.83
_cell_angle_gamma   47.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2CoAg
_chemical_formula_sum   'In2 Co1 Ag1'
_cell_volume   76.59
_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
  In  In2  1  0.49  0.0  0.26  1.0
  In  In3  1  0.0  0.0  0.74  1.0
  Co  Co1  1  0.0  0.0  0.05  1.0
  Ag  Ag0  1  0.49  0.0  0.72  1.0

data_In2CoAg
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.97
_cell_length_b   4.35
_cell_length_c   6.48
_cell_angle_alpha   109.59
_cell_angle_beta   103.25
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2CoAg
_chemical_formula_sum   'In2 Co1 Ag1'
_cell_volume   76.59
_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
  In  In0  1  0.22  0.74  0.22  1.0
  In  In1  1  0.26  0.26  0.26  1.0
  Co  Co2  1  0.95  0.95  0.95  1.0
  Ag  Ag3  1  0.77  0.28  0.77  1.0

In In Co Ag
In In Co Ag 0 1 o o - 0 1 + o o 0 2 o o o 1 2 o o + 2 3 - o - 