data_InSiTc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22
_cell_length_b   5.22
_cell_length_c   5.22
_cell_angle_alpha   143.88
_cell_angle_beta   143.88
_cell_angle_gamma   52.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InSiTc
_chemical_formula_sum   'In1 Si1 Tc1'
_cell_volume   49.15
_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
  In  In0  1  0.0  0.0  0.38  1.0
  Si  Si1  1  0.0  0.0  0.54  1.0
  Tc  Tc2  1  0.0  0.0  0.84  1.0

data_InSiTc
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.58
_cell_length_b   4.58
_cell_length_c   5.22
_cell_angle_alpha   90.0
_cell_angle_beta   116.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   InSiTc
_chemical_formula_sum   'In2 Si2 Tc2'
_cell_volume   98.29
_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
  In  In0  2  0.0  0.0  0.62  1.0
  Tc  Tc1  2  0.0  0.0  0.16  1.0
  Si  Si2  2  0.0  0.0  0.46  1.0

In Si Tc
In Si Tc 0 1 o o o 1 2 o o o 