data_Re3C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.88
_cell_length_b   2.91
_cell_length_c   6.47
_cell_angle_alpha   90.0
_cell_angle_beta   90.82
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Re3C
_chemical_formula_sum   'Re3 C1'
_cell_volume   54.29
_cell_formula_units_Z   1
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
  Re  Re1  1  0.95  0.45  0.06  1.0
  Re  Re2  1  0.4  0.0  0.24  1.0
  Re  Re3  1  0.84  0.45  0.41  1.0
  C  C0  1  0.0  0.0  0.0  1.0

data_Re3C
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.88
_cell_length_b   2.91
_cell_length_c   6.47
_cell_angle_alpha   90.0
_cell_angle_beta   90.82
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Re3C
_chemical_formula_sum   'Re3 C1'
_cell_volume   54.29
_cell_formula_units_Z   1
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
  Re  Re0  1  0.4  0.0  0.24  1.0
  Re  Re1  1  0.84  0.45  0.41  1.0
  Re  Re2  1  0.95  0.45  0.06  1.0
  C  C3  1  0.0  0.0  0.0  1.0

Re Re Re C
Re Re Re C 0 3 + o o 0 3 + + o 0 1 + + o 0 1 + o o 0 1 o + o 0 1 o o o 0 2 o o o 1 2 - - o 1 2 - o o 1 2 o - o 1 2 o o o 1 3 o o o 1 3 + o o 