data_MgSbW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.08
_cell_length_b   5.08
_cell_length_c   4.77
_cell_angle_alpha   97.78
_cell_angle_beta   97.78
_cell_angle_gamma   36.9
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSbW2
_chemical_formula_sum   'Mg1 Sb1 W2'
_cell_volume   73.16
_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
  Mg  Mg0  1  0.0  0.0  0.0  1.0
  Sb  Sb1  1  0.48  0.0  0.36  1.0
  W  W2  1  0.88  0.0  0.67  1.0
  W  W3  1  0.08  0.0  0.05  1.0

data_MgSbW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.22
_cell_length_b   4.77
_cell_length_c   5.08
_cell_angle_alpha   97.78
_cell_angle_beta   108.45
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSbW2
_chemical_formula_sum   'Mg1 Sb1 W2'
_cell_volume   73.16
_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
  Mg  Mg0  1  0.0  0.0  0.0  1.0
  Sb  Sb1  1  0.0  0.36  0.48  1.0
  W  W2  1  0.0  0.05  0.08  1.0
  W  W3  1  0.0  0.67  0.88  1.0

Mg Sb W W