data_[Co4Ag2As2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Ag  1.9300  1.6000  1.0867
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.2111]
_cell_length_b [2.8500]
_cell_length_c [5.6895]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.2944]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Co2AgAs]
_chemical_formula_sum '[Co4 Ag2 As2]'
_cell_volume [115.0483]
_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
[
  Co  Co0  4  0.2408  0.0000  0.1909  1
  Ag  Ag1  2  0.0000  0.0000  0.5000  1
  As  As2  2  0.0000  0.5000  0.0000  1
]