data_SiTc2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.55
_cell_length_b   4.55
_cell_length_c   4.8
_cell_angle_alpha   96.85
_cell_angle_beta   96.85
_cell_angle_gamma   36.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SiTc2W
_chemical_formula_sum   'Si1 Tc2 W1'
_cell_volume   58.46
_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
  Si  Si0  1  0.0  0.0  0.0  1.0
  Tc  Tc1  1  0.72  0.0  0.63  1.0
  Tc  Tc2  1  0.31  0.0  0.14  1.0
  W  W3  1  0.02  0.0  0.38  1.0

data_SiTc2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.84
_cell_length_b   4.55
_cell_length_c   4.8
_cell_angle_alpha   96.85
_cell_angle_beta   90.0
_cell_angle_gamma   108.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SiTc2W
_chemical_formula_sum   'Si1 Tc2 W1'
_cell_volume   58.46
_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
  Si  Si0  1  0.0  0.0  0.0  1.0
  Tc  Tc1  1  0.0  0.28  0.37  1.0
  Tc  Tc2  1  0.0  0.69  0.86  1.0
  W  W3  1  0.0  0.98  0.62  1.0

Si Tc Tc W
Si Tc Tc W 0 2 o o o 0 1 - o - 0 3 o o o 1 3 + o o 2 3 o o o 