data_ZrGaSn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81
_cell_length_b   5.81
_cell_length_c   5.81
_cell_angle_alpha   137.38
_cell_angle_beta   137.38
_cell_angle_gamma   61.86
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrGaSn2
_chemical_formula_sum   'Zr1 Ga1 Sn2'
_cell_volume   89.03
_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  0.0  0.11  0.49  1.0
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Sn  Sn1  1  0.11  0.0  0.49  1.0
  Sn  Sn2  1  0.0  0.0  0.99  1.0

data_ZrGaSn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.23
_cell_length_b   4.23
_cell_length_c   5.81
_cell_angle_alpha   111.31
_cell_angle_beta   111.31
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrGaSn2
_chemical_formula_sum   'Zr1 Ga1 Sn2'
_cell_volume   89.03
_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  0.62  0.11  0.62  1.0
  Ga  Ga1  1  0.0  0.0  0.0  1.0
  Sn  Sn2  1  0.01  0.0  0.01  1.0
  Sn  Sn3  1  0.51  0.0  0.62  1.0

Zr Ga Sn Sn