data_BeSiMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.02
_cell_length_b   5.9
_cell_length_c   2.65
_cell_angle_alpha   79.7
_cell_angle_beta   74.66
_cell_angle_gamma   25.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeSiMo
_chemical_formula_sum   'Be1 Si1 Mo1'
_cell_volume   38.93
_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  0.67  0.05  0.29  1.0
  Si  Si2  1  0.67  0.05  0.86  1.0
  Mo  Mo1  1  0.67  0.05  0.49  1.0

data_BeSiMo
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.35
_cell_length_b   11.33
_cell_length_c   2.65
_cell_angle_alpha   90.0
_cell_angle_beta   129.15
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BeSiMo
_chemical_formula_sum   'Be2 Si2 Mo2'
_cell_volume   77.86
_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
  Be  Be0  2  0.29  0.0  0.97  1.0
  Si  Si1  2  0.36  0.5  0.54  1.0
  Mo  Mo2  2  0.49  0.0  0.17  1.0

Be Si Mo
Be Si Mo 0 2 o o o 0 1 o o - 1 2 o o o 