# generated using pymatgen
data_Zr4Re2N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.85368401
_cell_length_b   8.85368401
_cell_length_c   8.85368401
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr4Re2N
_chemical_formula_sum   'Zr16 Re8 N4'
_cell_volume   490.74632419
_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
  Zr  Zr0  1  0.12500000  0.62500000  0.62500000  1.0
  Zr  Zr1  1  0.62500000  0.12500000  0.62500000  1.0
  Zr  Zr2  1  0.62500000  0.62500000  0.12500000  1.0
  Zr  Zr3  1  0.62500000  0.62500000  0.62500000  1.0
  Zr  Zr4  1  0.81414000  0.81414000  0.18586000  1.0
  Zr  Zr5  1  0.18586000  0.18586000  0.81414000  1.0
  Zr  Zr6  1  0.81414000  0.18586000  0.81414000  1.0
  Zr  Zr7  1  0.18586000  0.81414000  0.18586000  1.0
  Zr  Zr8  1  0.18586000  0.81414000  0.81414000  1.0
  Zr  Zr9  1  0.81414000  0.18586000  0.18586000  1.0
  Zr  Zr10  1  0.43586000  0.43586000  0.06414000  1.0
  Zr  Zr11  1  0.06414000  0.06414000  0.43586000  1.0
  Zr  Zr12  1  0.43586000  0.06414000  0.43586000  1.0
  Zr  Zr13  1  0.06414000  0.43586000  0.06414000  1.0
  Zr  Zr14  1  0.06414000  0.43586000  0.43586000  1.0
  Zr  Zr15  1  0.43586000  0.06414000  0.06414000  1.0
  Re  Re16  1  0.74911600  0.41696100  0.41696100  1.0
  Re  Re17  1  0.41696100  0.74911600  0.41696100  1.0
  Re  Re18  1  0.41696100  0.41696100  0.74911600  1.0
  Re  Re19  1  0.41696100  0.41696100  0.41696100  1.0
  Re  Re20  1  0.50088400  0.83303900  0.83303900  1.0
  Re  Re21  1  0.83303900  0.50088400  0.83303900  1.0
  Re  Re22  1  0.83303900  0.83303900  0.50088400  1.0
  Re  Re23  1  0.83303900  0.83303900  0.83303900  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