# generated using pymatgen
data_ScTa2(GaIr)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.41917807
_cell_length_b   7.41714515
_cell_length_c   2.97517167
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00906703
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTa2(GaIr)3
_chemical_formula_sum   'Sc1 Ta2 Ga3 Ir3'
_cell_volume   141.77365885
_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
  Sc  Sc0  1  0.37679553  0.00000000  0.50000100  1.0
  Ta  Ta1  1  0.99993904  0.37075296  0.50000100  1.0
  Ta  Ta2  1  0.62918508  0.62924804  0.50000100  1.0
  Ga  Ga3  1  0.70491113  0.00000000  0.00000000  1.0
  Ga  Ga4  1  0.29069802  0.28845162  0.00000000  1.0
  Ga  Ga5  1  0.00224641  0.71154938  0.00000000  1.0
  Ir  Ir6  1  0.67292909  0.33995528  0.00000000  1.0
  Ir  Ir7  1  0.33297481  0.66004572  0.00000000  1.0
  Ir  Ir8  1  0.99032289  0.00000000  0.50000100  1.0