data_[Ca4Ga6Ag2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Ga  1.8100  1.3000  0.7600
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.7506]
_cell_length_b [4.5437]
_cell_length_c [7.2997]
_cell_angle_alpha [90.0000]
_cell_angle_beta [132.2395]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Ca2Ga3Ag]
_chemical_formula_sum '[Ca4 Ga6 Ag2]'
_cell_volume [263.9843]
_cell_formula_units_Z [2]
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  2  0.0429  0.5000  0.2947  1
  Ca  Ca1  2  0.4585  0.0000  0.7081  1
  Ga  Ga2  2  0.1609  0.0000  0.1132  1
  Ga  Ga3  2  0.3351  0.5000  0.2766  1
  Ga  Ga4  2  0.3380  0.5000  0.8947  1
  Ag  Ag5  2  0.1646  0.0000  0.7127  1
]