# generated using pymatgen
data_Th2GaSi3Ni4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.06840048
_cell_length_b   4.06840048
_cell_length_c   9.60656919
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2GaSi3Ni4
_chemical_formula_sum   'Th2 Ga1 Si3 Ni4'
_cell_volume   159.00680431
_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  0.50000000  0.24299002  1.0
  Th  Th1  1  0.50000000  0.00000000  0.75700998  1.0
  Ga  Ga2  1  0.50000000  0.50000000  0.50000000  1.0
  Si  Si3  1  0.50000000  0.00000000  0.12491346  1.0
  Si  Si4  1  0.00000000  0.00000000  0.50000000  1.0
  Si  Si5  1  0.00000000  0.50000000  0.87508654  1.0
  Ni  Ni6  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni7  1  0.50000000  0.50000000  0.00000000  1.0
  Ni  Ni8  1  0.50000000  0.00000000  0.36945454  1.0
  Ni  Ni9  1  0.00000000  0.50000000  0.63054546  1.0