# generated using pymatgen
data_Ta3GaCuN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.92602022
_cell_length_b   6.92602022
_cell_length_c   6.92602022
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3GaCuN
_chemical_formula_sum   'Ta12 Ga4 Cu4 N4'
_cell_volume   332.23950037
_cell_formula_units_Z   4
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
  Ta  Ta0  1  0.79326242  0.95654668  0.37450260  1.0
  Ta  Ta1  1  0.70673758  0.04345332  0.87450260  1.0
  Ta  Ta2  1  0.20673758  0.45654668  0.12549740  1.0
  Ta  Ta3  1  0.29326242  0.54345332  0.62549740  1.0
  Ta  Ta4  1  0.95654668  0.37450260  0.79326242  1.0
  Ta  Ta5  1  0.04345332  0.87450260  0.70673758  1.0
  Ta  Ta6  1  0.45654668  0.12549740  0.20673758  1.0
  Ta  Ta7  1  0.54345332  0.62549740  0.29326242  1.0
  Ta  Ta8  1  0.37450260  0.79326242  0.95654668  1.0
  Ta  Ta9  1  0.87450260  0.70673758  0.04345332  1.0
  Ta  Ta10  1  0.12549740  0.20673758  0.45654668  1.0
  Ta  Ta11  1  0.62549740  0.29326242  0.54345332  1.0
  Ga  Ga12  1  0.57256813  0.42743187  0.92743187  1.0
  Ga  Ga13  1  0.42743187  0.92743187  0.57256813  1.0
  Ga  Ga14  1  0.92743187  0.57256813  0.42743187  1.0
  Ga  Ga15  1  0.07256813  0.07256813  0.07256813  1.0
  Cu  Cu16  1  0.17943381  0.82056619  0.32056619  1.0
  Cu  Cu17  1  0.32056619  0.17943381  0.82056619  1.0
  Cu  Cu18  1  0.82056619  0.32056619  0.17943381  1.0
  Cu  Cu19  1  0.67943381  0.67943381  0.67943381  1.0
  N  N20  1  0.87608731  0.12391269  0.62391269  1.0
  N  N21  1  0.62391269  0.87608731  0.12391269  1.0
  N  N22  1  0.12391269  0.62391269  0.87608731  1.0
  N  N23  1  0.37608731  0.37608731  0.37608731  1.0