data_BeNi2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.53
_cell_length_b   3.9
_cell_length_c   4.65
_cell_angle_alpha   90.0
_cell_angle_beta   98.51
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeNi2Os
_chemical_formula_sum   'Be1 Ni2 Os1'
_cell_volume   45.34
_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
  Be  Be0  1  0.99  0.0  0.54  1.0
  Ni  Ni1  1  0.38  0.95  0.46  1.0
  Ni  Ni2  1  0.94  0.0  0.2  1.0
  Os  Os3  1  0.76  0.95  0.28  1.0

data_BeNi2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.53
_cell_length_b   3.9
_cell_length_c   4.65
_cell_angle_alpha   90.0
_cell_angle_beta   98.51
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeNi2Os
_chemical_formula_sum   'Be1 Ni2 Os1'
_cell_volume   45.34
_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
  Be  Be0  1  0.99  0.0  0.54  1.0
  Ni  Ni1  1  0.38  0.95  0.46  1.0
  Ni  Ni2  1  0.94  0.0  0.2  1.0
  Os  Os3  1  0.76  0.95  0.28  1.0

Be Ni Ni Os