data_[Sc4Zn7Ag1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Zn  1.6500  1.3500  0.8800
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.5015]
_cell_length_b [5.6333]
_cell_length_c [7.8797]
_cell_angle_alpha [80.9430]
_cell_angle_beta [77.0082]
_cell_angle_gamma [66.4225]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Sc4Zn7Ag]
_chemical_formula_sum '[Sc4 Zn7 Ag1]'
_cell_volume [217.4652]
_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
[
  Sc  Sc0  2  0.1563  0.2585  0.6276  1
  Sc  Sc1  2  0.4907  0.3483  0.2070  1
  Zn  Zn2  2  0.0464  0.1868  0.2880  1
  Zn  Zn3  2  0.3283  0.7352  0.4591  1
  Zn  Zn4  2  0.4895  0.8433  0.1284  1
  Zn  Zn5  1  0.0000  0.5000  0.0000  1
  Ag  Ag6  1  0.0000  0.0000  0.0000  1
]