data_In2TcAs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.31
_cell_length_b   5.31
_cell_length_c   5.31
_cell_angle_alpha   133.5
_cell_angle_beta   133.5
_cell_angle_gamma   67.87
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2TcAs
_chemical_formula_sum   'In2 Tc1 As1'
_cell_volume   77.59
_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  In1  1  0.1  0.0  0.2  1.0
  In  In2  1  0.0  0.1  0.2  1.0
  Tc  Tc3  1  0.0  0.0  0.41  1.0
  As  As0  1  0.0  0.0  0.0  1.0

data_In2TcAs
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.93
_cell_length_b   5.93
_cell_length_c   5.31
_cell_angle_alpha   90.0
_cell_angle_beta   123.93
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   In2TcAs
_chemical_formula_sum   'In4 Tc2 As2'
_cell_volume   155.17
_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  4  0.34  0.45  0.89  1.0
  Tc  Tc1  2  0.09  0.5  0.59  1.0
  As  As2  2  0.0  0.0  0.0  1.0

In In Tc As
In In Tc As 0 1 o o o 0 2 o o o 0 3 o o o 1 2 o o o 1 3 o o o 