data_MnBe2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.49
_cell_length_b   4.49
_cell_length_c   4.49
_cell_angle_alpha   143.5
_cell_angle_beta   129.78
_cell_angle_gamma   63.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnBe2Os
_chemical_formula_sum   'Mn1 Be2 Os1'
_cell_volume   41.01
_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
  Mn  Mn2  1  0.0  0.0  0.74  1.0
  Be  Be0  1  0.0  0.0  0.12  1.0
  Be  Be1  1  0.41  0.0  0.82  1.0
  Os  Os3  1  0.0  0.91  0.96  1.0

data_MnBe2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   3.81
_cell_length_c   4.49
_cell_angle_alpha   115.11
_cell_angle_beta   108.25
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnBe2Os
_chemical_formula_sum   'Mn1 Be2 Os1'
_cell_volume   41.01
_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
  Mn  Mn0  1  0.26  0.26  0.26  1.0
  Be  Be1  1  0.59  0.18  0.59  1.0
  Be  Be2  1  0.88  0.88  0.88  1.0
  Os  Os3  1  0.04  0.94  0.94  1.0

Mn Be Be Os