data_CrSn2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.31
_cell_length_b   5.31
_cell_length_c   5.31
_cell_angle_alpha   128.81
_cell_angle_beta   128.81
_cell_angle_gamma   75.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrSn2Sb
_chemical_formula_sum   'Cr1 Sn2 Sb1'
_cell_volume   88.57
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Sn  Sn2  1  0.0  0.0  0.21  1.0
  Sn  Sn3  1  0.0  0.29  0.1  1.0
  Sb  Sb1  1  0.29  0.0  0.1  1.0

data_CrSn2Sb
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.59
_cell_length_b   4.59
_cell_length_c   5.31
_cell_angle_alpha   115.6
_cell_angle_beta   115.6
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrSn2Sb
_chemical_formula_sum   'Cr1 Sn2 Sb1'
_cell_volume   88.57
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Sn  Sn1  1  0.21  0.21  0.21  1.0
  Sn  Sn2  1  0.81  0.1  0.81  1.0
  Sb  Sb3  1  0.1  0.81  0.81  1.0

Cr Sn Sn Sb
Cr Sn Sn Sb 0 2 o o o 0 3 o o o 0 1 o o o 