data_InWSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.27
_cell_length_b   3.27
_cell_length_c   9.41
_cell_angle_alpha   94.31
_cell_angle_beta   94.31
_cell_angle_gamma   62.03
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InWSe2
_chemical_formula_sum   'In1 W1 Se2'
_cell_volume   88.47
_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  0.0  1.0
  W  W3  1  0.39  0.0  0.68  1.0
  Se  Se1  1  0.64  0.0  0.42  1.0
  Se  Se2  1  0.14  0.0  0.95  1.0

data_InWSe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.27
_cell_length_b   3.27
_cell_length_c   9.41
_cell_angle_alpha   85.69
_cell_angle_beta   85.69
_cell_angle_gamma   62.03
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InWSe2
_chemical_formula_sum   'In1 W1 Se2'
_cell_volume   88.47
_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  0.0  1.0
  W  W1  1  0.61  0.0  0.68  1.0
  Se  Se2  1  0.36  0.0  0.42  1.0
  Se  Se3  1  0.86  0.0  0.95  1.0

In W Se Se