data_CrGeSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.0
_cell_length_b   4.0
_cell_length_c   7.05
_cell_angle_alpha   105.55
_cell_angle_beta   105.55
_cell_angle_gamma   57.93
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrGeSb2
_chemical_formula_sum   'Cr1 Ge1 Sb2'
_cell_volume   91.2
_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
  Ge  Ge1  1  0.42  0.0  0.36  1.0
  Sb  Sb2  1  0.71  0.0  0.52  1.0
  Sb  Sb3  1  0.13  0.0  0.19  1.0

data_CrGeSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.88
_cell_length_b   4.0
_cell_length_c   7.05
_cell_angle_alpha   105.55
_cell_angle_beta   90.0
_cell_angle_gamma   118.97
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrGeSb2
_chemical_formula_sum   'Cr1 Ge1 Sb2'
_cell_volume   91.2
_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
  Ge  Ge1  1  0.0  0.58  0.64  1.0
  Sb  Sb2  1  0.0  0.29  0.48  1.0
  Sb  Sb3  1  0.0  0.87  0.81  1.0

Cr Ge Sb Sb