data_SrLi2B
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.69
_cell_length_b   5.69
_cell_length_c   5.69
_cell_angle_alpha   145.67
_cell_angle_beta   127.28
_cell_angle_gamma   64.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrLi2B
_chemical_formula_sum   'Sr1 Li2 B1'
_cell_volume   81.76
_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
  Sr  Sr3  1  0.0  0.0  0.82  1.0
  Li  Li1  1  0.0  0.53  0.12  1.0
  Li  Li2  1  0.68  0.0  0.7  1.0
  B  B0  1  0.0  0.0  0.0  1.0

data_SrLi2B
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.36
_cell_length_b   5.05
_cell_length_c   5.69
_cell_angle_alpha   116.36
_cell_angle_beta   107.16
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrLi2B
_chemical_formula_sum   'Sr1 Li2 B1'
_cell_volume   81.76
_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
  Sr  Sr0  1  0.0  0.82  0.82  1.0
  Li  Li1  1  0.0  0.7  0.02  1.0
  Li  Li2  1  0.47  0.59  0.59  1.0
  B  B3  1  0.0  0.0  0.0  1.0

Sr Li Li B