data_ZrBeSn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.72
_cell_length_b   5.72
_cell_length_c   5.04
_cell_angle_alpha   115.25
_cell_angle_beta   115.25
_cell_angle_gamma   33.45
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrBeSn2
_chemical_formula_sum   'Zr1 Be1 Sn2'
_cell_volume   81.4
_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
  Zr  Zr3  1  0.16  0.0  0.87  1.0
  Be  Be0  1  0.45  0.0  0.53  1.0
  Sn  Sn1  1  0.17  0.0  0.49  1.0
  Sn  Sn2  1  0.04  0.0  0.4  1.0

data_ZrBeSn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.29
_cell_length_b   5.04
_cell_length_c   5.72
_cell_angle_alpha   115.25
_cell_angle_beta   106.73
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrBeSn2
_chemical_formula_sum   'Zr1 Be1 Sn2'
_cell_volume   81.4
_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
  Zr  Zr0  1  0.0  0.87  0.16  1.0
  Be  Be1  1  0.0  0.53  0.45  1.0
  Sn  Sn2  1  0.0  0.4  0.04  1.0
  Sn  Sn3  1  0.0  0.49  0.17  1.0

Zr Be Sn Sn