data_Pr3NF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.03
_cell_length_b   5.98
_cell_length_c   7.15
_cell_angle_alpha   65.8
_cell_angle_beta   75.55
_cell_angle_gamma   89.67
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr3NF6
_chemical_formula_sum   'Pr3 N1 F6'
_cell_volume   151.3
_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  0.86  0.22  0.0  1.0
  Pr  Pr1  1  0.93  0.97  0.94  1.0
  Pr  Pr2  1  1.0  0.88  0.35  1.0
  N  N3  1  0.8  0.65  0.0  1.0
  F  F4  1  0.89  0.46  0.23  1.0
  F  F5  1  0.09  0.3  0.07  1.0
  F  F6  1  0.99  0.28  0.58  1.0
  F  F7  1  0.83  0.45  0.24  1.0
  F  F8  1  0.68  0.5  0.04  1.0
  F  F9  1  0.98  0.36  0.47  1.0

data_Pr3NF6
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.03
_cell_length_b   5.98
_cell_length_c   7.15
_cell_angle_alpha   65.8
_cell_angle_beta   75.55
_cell_angle_gamma   89.67
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr3NF6
_chemical_formula_sum   'Pr3 N1 F6'
_cell_volume   151.3
_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  0.86  0.22  0.0  1.0
  Pr  Pr1  1  0.93  0.97  0.94  1.0
  Pr  Pr2  1  1.0  0.88  0.35  1.0
  N  N3  1  0.8  0.65  0.0  1.0
  F  F4  1  0.09  0.3  0.07  1.0
  F  F5  1  0.68  0.5  0.04  1.0
  F  F6  1  0.83  0.45  0.24  1.0
  F  F7  1  0.89  0.46  0.23  1.0
  F  F8  1  0.98  0.36  0.47  1.0
  F  F9  1  0.99  0.28  0.58  1.0

Pr Pr Pr N F F F F F F
Pr Pr Pr N F F F F F F 0 5 + o o 0 1 o - - 0 2 o - o 1 3 o o + 1 2 o o + 2 7 o o o 2 4 o o o 2 4 o + o 2 9 o o o 2 6 o o o 2 5 + + o 3 8 o o o 4 7 o o o 6 9 o o o 