data_NaSr2In
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.64
_cell_length_b   6.64
_cell_length_c   6.32
_cell_angle_alpha   98.35
_cell_angle_beta   98.35
_cell_angle_gamma   34.34
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaSr2In
_chemical_formula_sum   'Na1 Sr2 In1'
_cell_volume   155.65
_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
  Na  Na1  1  0.44  0.0  0.68  1.0
  Sr  Sr2  1  0.72  0.0  0.23  1.0
  Sr  Sr3  1  0.31  0.0  0.61  1.0
  In  In0  1  0.87  0.0  0.11  1.0

data_NaSr2In
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.92
_cell_length_b   6.32
_cell_length_c   6.64
_cell_angle_alpha   98.35
_cell_angle_beta   107.17
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaSr2In
_chemical_formula_sum   'Na1 Sr2 In1'
_cell_volume   155.65
_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
  Na  Na0  1  0.0  0.68  0.44  1.0
  Sr  Sr1  1  0.0  0.23  0.72  1.0
  Sr  Sr2  1  0.0  0.61  0.31  1.0
  In  In3  1  0.0  0.11  0.87  1.0

Na Sr Sr In