# generated using pymatgen
data_Th3AlGa2Ni3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.99644439
_cell_length_b   6.95197385
_cell_length_c   4.06456930
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.78996782
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3AlGa2Ni3
_chemical_formula_sum   'Th3 Al1 Ga2 Ni3'
_cell_volume   171.57181527
_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  0.00000000  0.41955298  0.50000000  1.0
  Th  Th1  1  0.57786371  0.57760836  0.50000000  1.0
  Th  Th2  1  0.42213629  0.99974366  0.50000000  1.0
  Al  Al3  1  0.00000000  0.77283522  0.00000000  1.0
  Ga  Ga4  1  0.23357276  0.23187577  0.00000000  1.0
  Ga  Ga5  1  0.76642724  0.99830401  0.00000000  1.0
  Ni  Ni6  1  0.32728485  0.66728549  0.00000000  1.0
  Ni  Ni7  1  0.67271515  0.34000065  0.00000000  1.0
  Ni  Ni8  1  1.00000000  0.99279386  0.50000000  1.0