data_NbGaSi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.11
_cell_length_b   3.69
_cell_length_c   5.32
_cell_angle_alpha   90.0
_cell_angle_beta   90.25
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbGaSi2
_chemical_formula_sum   'Nb1 Ga1 Si2'
_cell_volume   61.15
_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
  Nb  Nb1  1  0.73  0.84  0.11  1.0
  Ga  Ga0  1  0.83  0.0  0.51  1.0
  Si  Si2  1  0.09  0.0  0.28  1.0
  Si  Si3  1  0.51  0.84  0.4  1.0

data_NbGaSi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.11
_cell_length_b   3.69
_cell_length_c   5.32
_cell_angle_alpha   90.0
_cell_angle_beta   90.25
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbGaSi2
_chemical_formula_sum   'Nb1 Ga1 Si2'
_cell_volume   61.15
_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
  Nb  Nb0  1  0.73  0.84  0.11  1.0
  Ga  Ga1  1  0.83  0.0  0.51  1.0
  Si  Si2  1  0.09  0.0  0.28  1.0
  Si  Si3  1  0.51  0.84  0.4  1.0

Nb Ga Si Si