# generated using pymatgen
data_Ta4Cu2N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.21744516
_cell_length_b   8.21744581
_cell_length_c   8.21708094
_cell_angle_alpha   60.00146483
_cell_angle_beta   60.00146222
_cell_angle_gamma   60.00229912
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta4Cu2N
_chemical_formula_sum   'Ta16 Cu8 N4'
_cell_volume   392.36782084
_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  0.12500000  0.62500000  0.62500000  1.0
  Ta  Ta1  1  0.62500000  0.12500000  0.62500000  1.0
  Ta  Ta2  1  0.62500000  0.62500000  0.12500000  1.0
  Ta  Ta3  1  0.62500000  0.62500000  0.62500000  1.0
  Ta  Ta4  1  0.81248851  0.81248851  0.18751149  1.0
  Ta  Ta5  1  0.18752261  0.18752261  0.81247739  1.0
  Ta  Ta6  1  0.81248009  0.18750868  0.81248128  1.0
  Ta  Ta7  1  0.18750868  0.81248009  0.18752995  1.0
  Ta  Ta8  1  0.18750868  0.81248009  0.81248128  1.0
  Ta  Ta9  1  0.81248009  0.18750868  0.18752995  1.0
  Ta  Ta10  1  0.43751149  0.43751149  0.06248851  1.0
  Ta  Ta11  1  0.06247739  0.06247739  0.43752261  1.0
  Ta  Ta12  1  0.43751991  0.06249132  0.43751872  1.0
  Ta  Ta13  1  0.06249132  0.43751991  0.06247005  1.0
  Ta  Ta14  1  0.06249132  0.43751991  0.43751872  1.0
  Ta  Ta15  1  0.43751991  0.06249132  0.06247005  1.0
  Cu  Cu16  1  0.75328908  0.41555598  0.41557747  1.0
  Cu  Cu17  1  0.41555598  0.75328908  0.41557747  1.0
  Cu  Cu18  1  0.41558059  0.41558059  0.75323480  1.0
  Cu  Cu19  1  0.41558059  0.41558059  0.41560301  1.0
  Cu  Cu20  1  0.49671092  0.83444402  0.83442253  1.0
  Cu  Cu21  1  0.83444402  0.49671092  0.83442253  1.0
  Cu  Cu22  1  0.83441941  0.83441941  0.49676520  1.0
  Cu  Cu23  1  0.83441941  0.83441941  0.83439699  1.0
  N  N24  1  0.62500000  0.12500000  0.12500000  1.0
  N  N25  1  0.12500000  0.62500000  0.12500000  1.0
  N  N26  1  0.12500000  0.12500000  0.62500000  1.0
  N  N27  1  0.12500000  0.12500000  0.12500000  1.0