data_PrY(Co3Ni2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.96
_cell_length_b   5.0
_cell_length_c   8.56
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrY(Co3Ni2)2
_chemical_formula_sum   'Pr1 Y1 Co6 Ni4'
_cell_volume   169.4
_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
  Pr  Pr0  1  0.98  0.5  0.0  1.0
  Y  Y1  1  0.98  0.0  0.28  1.0
  Co  Co2  1  0.98  0.5  0.92  1.0
  Co  Co3  1  0.98  0.0  0.14  1.0
  Co  Co4  1  0.98  0.0  0.42  1.0
  Co  Co5  1  0.98  0.5  0.64  1.0
  Co  Co6  1  0.0  0.5  0.28  1.0
  Co  Co7  1  0.0  0.0  0.0  1.0
  Ni  Ni8  1  0.0  0.77  0.17  1.0
  Ni  Ni9  1  0.0  0.24  0.39  1.0
  Ni  Ni10  1  0.0  0.24  0.17  1.0
  Ni  Ni11  1  0.0  0.77  0.39  1.0

data_PrY(Co3Ni2)2
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.96
_cell_length_b   5.0
_cell_length_c   8.56
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   PrY(Co3Ni2)2
_chemical_formula_sum   'Pr1 Y1 Co6 Ni4'
_cell_volume   169.4
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.98  0.5  -0.0  1.0
  Y  Y1  1  0.98  0.0  0.28  1.0
  Co  Co2  1  0.0  0.0  0.0  1.0
  Co  Co3  1  0.0  0.5  0.28  1.0
  Co  Co4  1  0.98  0.0  0.14  1.0
  Co  Co5  1  0.98  0.0  0.42  1.0
  Co  Co6  1  0.98  0.5  0.64  1.0
  Co  Co7  1  0.98  0.5  0.92  1.0
  Ni  Ni8  2  0.0  0.24  0.39  1.0
  Ni  Ni9  2  0.0  0.24  0.17  1.0

Pr Y Co Co Co Co Co Co Ni Ni Ni Ni
Pr Y Co Co Co Co Co Co Ni Ni Ni Ni 0 2 o o - 1 3 o o o 1 4 o o o 2 5 o o o 3 8 + - o 3 7 + o o 3 10 + o o 4 11 + - o 4 9 + o o 5 9 + o o 5 11 + o o 6 10 o o o 6 9 o o o 6 8 o o o 6 11 o o o 