data_ScTc2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33
_cell_length_b   5.33
_cell_length_c   5.33
_cell_angle_alpha   145.52
_cell_angle_beta   130.82
_cell_angle_gamma   61.44
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTc2W
_chemical_formula_sum   'Sc1 Tc2 W1'
_cell_volume   64.14
_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
  Sc  Sc0  1  0.0  0.0  0.89  1.0
  Tc  Tc1  1  0.58  0.0  0.07  1.0
  Tc  Tc2  1  0.0  0.0  0.3  1.0
  W  W3  1  0.58  0.0  0.48  1.0

data_ScTc2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.16
_cell_length_b   4.43
_cell_length_c   5.33
_cell_angle_alpha   114.59
_cell_angle_beta   107.24
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTc2W
_chemical_formula_sum   'Sc1 Tc2 W1'
_cell_volume   64.14
_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
  Sc  Sc0  1  0.11  0.11  0.11  1.0
  Tc  Tc1  1  0.51  0.93  0.51  1.0
  Tc  Tc2  1  0.7  0.7  0.7  1.0
  W  W3  1  0.1  0.52  0.1  1.0

Sc Tc Tc W