data_ScBeP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23
_cell_length_b   5.23
_cell_length_c   5.23
_cell_angle_alpha   140.43
_cell_angle_beta   139.85
_cell_angle_gamma   57.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScBeP2
_chemical_formula_sum   'Sc1 Be1 P2'
_cell_volume   58.09
_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
  Sc  Sc3  1  0.0  0.79  0.03  1.0
  Be  Be0  1  0.0  0.0  0.96  1.0
  P  P1  1  0.0  0.79  0.49  1.0
  P  P2  1  0.0  0.0  0.24  1.0

data_ScBeP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   3.59
_cell_length_c   5.23
_cell_angle_alpha   110.08
_cell_angle_beta   109.78
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScBeP2
_chemical_formula_sum   'Sc1 Be1 P2'
_cell_volume   58.09
_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
  Sc  Sc0  1  0.21  0.24  0.24  1.0
  Be  Be1  1  0.0  0.96  0.96  1.0
  P  P2  1  0.0  0.24  0.24  1.0
  P  P3  1  0.21  0.7  0.7  1.0

Sc Be P P