data_CrF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.82
_cell_length_b   5.82
_cell_length_c   5.82
_cell_angle_alpha   149.82
_cell_angle_beta   97.92
_cell_angle_gamma   89.87
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrF5
_chemical_formula_sum   'Cr1 F5'
_cell_volume   95.2
_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
  Cr  Cr0  1  0.0  0.82  0.0  1.0
  F  F1  1  0.51  0.6  0.0  1.0
  F  F2  1  0.0  0.22  0.12  1.0
  F  F3  1  0.0  0.82  0.77  1.0
  F  F4  1  0.51  0.0  0.35  1.0
  F  F5  1  0.0  0.0  0.0  1.0

data_CrF5
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.03
_cell_length_b   5.82
_cell_length_c   5.82
_cell_angle_alpha   82.08
_cell_angle_beta   74.91
_cell_angle_gamma   74.91
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrF5
_chemical_formula_sum   'Cr1 F5'
_cell_volume   95.2
_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
  Cr  Cr0  1  -0.0  0.0  0.82  1.0
  F  F1  1  0.0  0.0  0.0  1.0
  F  F2  1  0.12  0.0  0.1  1.0
  F  F3  1  0.49  0.51  0.6  1.0
  F  F4  1  0.77  0.0  0.05  1.0
  F  F5  1  0.83  0.51  0.65  1.0

Cr F F F F F
Cr F F F F F 0 5 o + o 1 4 o + o 2 5 o o o 3 5 o + + 