# generated using pymatgen
data_Nb3Co2ReN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.10988400
_cell_length_b   8.10988397
_cell_length_c   8.10988392
_cell_angle_alpha   60.00000018
_cell_angle_beta   60.00000031
_cell_angle_gamma   60.00000007
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3Co2ReN
_chemical_formula_sum   'Nb12 Co8 Re4 N4'
_cell_volume   377.16286434
_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
  Nb  Nb0  1  0.80752843  0.80752843  0.19247157  1.0
  Nb  Nb1  1  0.19247157  0.19247157  0.80752843  1.0
  Nb  Nb2  1  0.80752843  0.19247157  0.80752843  1.0
  Nb  Nb3  1  0.19247157  0.80752843  0.19247157  1.0
  Nb  Nb4  1  0.19247157  0.80752843  0.80752843  1.0
  Nb  Nb5  1  0.80752843  0.19247157  0.19247157  1.0
  Nb  Nb6  1  0.44247157  0.44247157  0.05752843  1.0
  Nb  Nb7  1  0.05752843  0.05752843  0.44247157  1.0
  Nb  Nb8  1  0.44247157  0.05752843  0.44247157  1.0
  Nb  Nb9  1  0.05752843  0.44247157  0.05752843  1.0
  Nb  Nb10  1  0.05752843  0.44247157  0.44247157  1.0
  Nb  Nb11  1  0.44247157  0.05752843  0.05752843  1.0
  Co  Co12  1  0.73174543  0.42275152  0.42275152  1.0
  Co  Co13  1  0.42275152  0.73174543  0.42275152  1.0
  Co  Co14  1  0.42275152  0.42275152  0.73174543  1.0
  Co  Co15  1  0.42275152  0.42275152  0.42275152  1.0
  Co  Co16  1  0.51825457  0.82724848  0.82724848  1.0
  Co  Co17  1  0.82724848  0.51825457  0.82724848  1.0
  Co  Co18  1  0.82724848  0.82724848  0.51825457  1.0
  Co  Co19  1  0.82724848  0.82724848  0.82724848  1.0
  Re  Re20  1  0.12500000  0.62500000  0.62500000  1.0
  Re  Re21  1  0.62500000  0.12500000  0.62500000  1.0
  Re  Re22  1  0.62500000  0.62500000  0.12500000  1.0
  Re  Re23  1  0.62500000  0.62500000  0.62500000  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