data_CoReN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.82
_cell_length_b   2.82
_cell_length_c   11.26
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoReN2
_chemical_formula_sum   'Co2 Re2 N4'
_cell_volume   77.77
_cell_formula_units_Z   2
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
  Co  Co0  1  0.0  0.0  0.63  1.0
  Co  Co1  1  0.0  0.0  0.0  1.0
  Re  Re2  1  0.41  0.82  0.44  1.0
  Re  Re3  1  0.0  0.63  0.81  1.0
  N  N4  1  0.41  0.82  0.5  1.0
  N  N5  1  0.0  0.63  0.76  1.0
  N  N6  1  0.0  0.63  0.13  1.0
  N  N7  1  0.41  0.82  0.13  1.0

data_CoReN2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   2.82
_cell_length_c   11.26
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoReN2
_chemical_formula_sum   'Co2 Re2 N4'
_cell_volume   77.77
_cell_formula_units_Z   2
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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.0  0.0  0.63  1.0
  Re  Re2  1  0.0  0.63  0.81  1.0
  Re  Re3  1  0.41  0.82  0.44  1.0
  N  N4  1  0.0  0.63  0.13  1.0
  N  N5  1  0.0  0.63  0.76  1.0
  N  N6  1  0.41  0.82  0.13  1.0
  N  N7  1  0.41  0.82  0.5  1.0

Co Co Re Re N N N N