# generated using pymatgen
data_Th3Al2GaNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.97687531
_cell_length_b   7.00999421
_cell_length_c   4.08171295
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.15370657
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3Al2GaNi3
_chemical_formula_sum   'Th3 Al2 Ga1 Ni3'
_cell_volume   172.61437893
_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
  Th  Th0  1  0.99999595  0.42448204  0.50000000  1.0
  Th  Th1  1  0.57907989  0.57860717  0.50000000  1.0
  Th  Th2  1  0.42091486  0.99952120  0.50000000  1.0
  Al  Al3  1  0.22760084  0.22812295  0.00000000  1.0
  Al  Al4  1  0.77239994  0.00052220  0.00000000  1.0
  Ga  Ga5  1  0.00000866  0.76907407  0.00000000  1.0
  Ni  Ni6  1  0.33884777  0.66532739  0.00000000  1.0
  Ni  Ni7  1  0.66114806  0.32647379  0.00000000  1.0
  Ni  Ni8  1  0.00000402  0.00787019  0.50000000  1.0