data_PrCo(CN)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.67
_cell_length_b   7.67
_cell_length_c   13.23
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrCo(CN)6
_chemical_formula_sum   'Pr2 Co2 C12 N12'
_cell_volume   673.78
_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
  Pr  Pr0  1  0.83  0.21  0.92  1.0
  Pr  Pr1  1  0.0  0.43  0.31  1.0
  Co  Co2  1  0.0  0.0  0.0  1.0
  Co  Co3  1  0.0  0.0  0.62  1.0
  C  C4  1  0.35  0.76  0.15  1.0
  C  C5  1  0.83  0.12  0.15  1.0
  C  C6  1  0.32  0.76  0.15  1.0
  C  C7  1  0.48  0.88  0.08  1.0
  C  C8  1  0.0  0.52  0.08  1.0
  C  C9  1  0.52  0.88  0.08  1.0
  C  C10  1  0.48  0.88  0.54  1.0
  C  C11  1  0.0  0.52  0.54  1.0
  C  C12  1  0.52  0.88  0.54  1.0
  C  C13  1  0.35  0.76  0.69  1.0
  C  C14  1  0.83  0.12  0.69  1.0
  C  C15  1  0.32  0.76  0.69  1.0
  N  N16  1  0.53  0.24  0.47  1.0
  N  N17  1  0.83  0.17  0.47  1.0
  N  N18  1  0.14  0.24  0.47  1.0
  N  N19  1  0.31  0.4  0.76  1.0
  N  N20  1  0.0  0.47  0.76  1.0
  N  N21  1  0.69  0.4  0.76  1.0
  N  N22  1  0.31  0.4  0.86  1.0
  N  N23  1  0.0  0.47  0.86  1.0
  N  N24  1  0.69  0.4  0.86  1.0
  N  N25  1  0.53  0.24  0.37  1.0
  N  N26  1  0.83  0.17  0.37  1.0
  N  N27  1  0.14  0.24  0.37  1.0

data_PrCo(CN)6
_symmetry_space_group_name_H-M   P1
_cell_length_a   7.67
_cell_length_b   7.67
_cell_length_c   13.23
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrCo(CN)6
_chemical_formula_sum   'Pr2 Co2 C12 N12'
_cell_volume   673.78
_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
  Pr  Pr0  1  0.0  0.43  0.31  1.0
  Pr  Pr1  1  0.83  0.21  0.92  1.0
  Co  Co2  1  0.0  0.0  0.0  1.0
  Co  Co3  1  0.0  0.0  0.62  1.0
  C  C4  1  0.0  0.52  0.08  1.0
  C  C5  1  0.0  0.52  0.54  1.0
  C  C6  1  0.32  0.76  0.15  1.0
  C  C7  1  0.32  0.76  0.69  1.0
  C  C8  1  0.35  0.76  0.15  1.0
  C  C9  1  0.35  0.76  0.69  1.0
  C  C10  1  0.48  0.88  0.08  1.0
  C  C11  1  0.48  0.88  0.54  1.0
  C  C12  1  0.52  0.88  0.08  1.0
  C  C13  1  0.52  0.88  0.54  1.0
  C  C14  1  0.83  0.12  0.15  1.0
  C  C15  1  0.83  0.12  0.69  1.0
  N  N16  1  0.0  0.47  0.76  1.0
  N  N17  1  0.0  0.47  0.86  1.0
  N  N18  1  0.14  0.24  0.37  1.0
  N  N19  1  0.14  0.24  0.47  1.0
  N  N20  1  0.31  0.4  0.76  1.0
  N  N21  1  0.31  0.4  0.86  1.0
  N  N22  1  0.53  0.24  0.37  1.0
  N  N23  1  0.53  0.24  0.47  1.0
  N  N24  1  0.69  0.4  0.76  1.0
  N  N25  1  0.69  0.4  0.86  1.0
  N  N26  1  0.83  0.17  0.37  1.0
  N  N27  1  0.83  0.17  0.47  1.0

Pr Pr Co Co C C C C C C C C C C C C N N N N N N N N N N N N
Pr Pr Co Co C C C C C C C C C C C C N N N N N N N N N N N N 0 23 + o o 0 2 + o + 0 5 o o + 0 8 + o + 1 26 - o o 1 5 - o o 1 8 o o o 1 11 o o o 2 5 - o o 3 14 - o o 3 18 o o o 4 6 o o o 4 8 o o o 5 9 o - o 5 7 o - o 5 8 + o o 5 26 o o o 6 8 o o o 7 9 o o o 8 23 o o - 10 12 o o o 10 11 o o o 11 16 - o o 11 18 o o o 11 26 - o o 11 17 - o o 11 20 o o o 11 14 - o o 11 15 o o o 11 13 o o o 11 12 o o o 13 15 o o o 14 20 + o o 16 25 o o o 17 26 o o o 18 27 o o o 19 22 o o o 20 23 o o o 21 24 o o o 