data_SrBeMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.09
_cell_length_b   6.09
_cell_length_c   6.09
_cell_angle_alpha   148.44
_cell_angle_beta   148.44
_cell_angle_gamma   45.23
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrBeMo
_chemical_formula_sum   'Sr1 Be1 Mo1'
_cell_volume   61.55
_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  Sr2  1  0.0  0.0  0.53  1.0
  Be  Be0  1  0.0  0.0  0.54  1.0
  Mo  Mo1  1  0.0  0.0  0.41  1.0

data_SrBeMo
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.68
_cell_length_b   4.68
_cell_length_c   6.09
_cell_angle_alpha   90.0
_cell_angle_beta   112.62
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   SrBeMo
_chemical_formula_sum   'Sr2 Be2 Mo2'
_cell_volume   123.1
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.47  1.0
  Be  Be1  2  0.0  0.0  0.46  1.0
  Mo  Mo2  2  0.0  0.0  0.59  1.0

Sr Be Mo