data_CoNiSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.47
_cell_length_b   6.47
_cell_length_c   6.47
_cell_angle_alpha   152.53
_cell_angle_beta   145.68
_cell_angle_gamma   44.51
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoNiSb2
_chemical_formula_sum   'Co1 Ni1 Sb2'
_cell_volume   70.22
_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
  Co  Co0  1  0.0  0.0  0.65  1.0
  Ni  Ni1  1  0.0  0.91  0.28  1.0
  Sb  Sb2  1  0.0  0.0  0.49  1.0
  Sb  Sb3  1  0.54  0.0  0.55  1.0

data_CoNiSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.07
_cell_length_b   3.82
_cell_length_c   6.47
_cell_angle_alpha   107.16
_cell_angle_beta   103.73
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoNiSb2
_chemical_formula_sum   'Co1 Ni1 Sb2'
_cell_volume   70.22
_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
  Co  Co0  1  0.0  0.65  0.65  1.0
  Ni  Ni1  1  0.09  0.37  0.37  1.0
  Sb  Sb2  1  0.0  0.49  0.49  1.0
  Sb  Sb3  1  0.0  0.55  0.01  1.0

Co Ni Sb Sb