data_Cr2AgB
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.43
_cell_length_b   4.43
_cell_length_c   4.71
_cell_angle_alpha   120.46
_cell_angle_beta   120.46
_cell_angle_gamma   38.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2AgB
_chemical_formula_sum   'Cr2 Ag1 B1'
_cell_volume   48.33
_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  Cr2  1  0.73  0.0  0.58  1.0
  Cr  Cr3  1  0.61  0.0  0.69  1.0
  Ag  Ag0  1  0.31  0.0  0.97  1.0
  B  B1  1  0.97  0.0  0.69  1.0

data_Cr2AgB
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.91
_cell_length_b   4.43
_cell_length_c   4.54
_cell_angle_alpha   63.24
_cell_angle_beta   71.34
_cell_angle_gamma   70.86
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2AgB
_chemical_formula_sum   'Cr2 Ag1 B1'
_cell_volume   48.33
_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  0.15  0.58  1.0
  Cr  Cr1  1  0.0  0.92  0.69  1.0
  Ag  Ag2  1  0.0  0.34  0.97  1.0
  B  B3  1  0.0  0.28  0.69  1.0

Cr Cr Ag B