data_CaAg2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.07
_cell_length_b   6.07
_cell_length_c   6.07
_cell_angle_alpha   152.56
_cell_angle_beta   129.33
_cell_angle_gamma   58.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaAg2W
_chemical_formula_sum   'Ca1 Ag2 W1'
_cell_volume   79.09
_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
  Ca  Ca2  1  0.0  0.0  0.24  1.0
  Ag  Ag0  1  0.0  0.0  0.02  1.0
  Ag  Ag1  1  0.44  0.0  0.47  1.0
  W  W3  1  0.0  0.6  0.85  1.0

data_CaAg2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.88
_cell_length_b   5.19
_cell_length_c   6.07
_cell_angle_alpha   115.34
_cell_angle_beta   103.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaAg2W
_chemical_formula_sum   'Ca1 Ag2 W1'
_cell_volume   79.09
_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
  Ca  Ca0  1  0.76  0.76  0.76  1.0
  Ag  Ag1  1  0.97  0.53  0.97  1.0
  Ag  Ag2  1  0.98  0.98  0.98  1.0
  W  W3  1  0.15  0.74  0.74  1.0

Ca Ag Ag W