# generated using pymatgen
data_Th3ZnGa2Ni3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.98164965
_cell_length_b   6.99745963
_cell_length_c   4.03204873
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.07495055
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3ZnGa2Ni3
_chemical_formula_sum   'Th3 Zn1 Ga2 Ni3'
_cell_volume   170.46152126
_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  1.00000000  0.42101168  0.50000000  1.0
  Th  Th1  1  0.58231521  0.58035024  0.50000000  1.0
  Th  Th2  1  0.41768479  0.99803503  0.50000000  1.0
  Zn  Zn3  1  0.00000000  0.76929669  0.00000000  1.0
  Ga  Ga4  1  0.22995386  0.22924506  0.00000000  1.0
  Ga  Ga5  1  0.77004614  0.99929020  0.00000000  1.0
  Ni  Ni6  1  0.33822350  0.66594496  0.00000000  1.0
  Ni  Ni7  1  0.66177650  0.32772146  0.00000000  1.0
  Ni  Ni8  1  1.00000000  0.00910469  0.50000000  1.0