data_HNF2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.95
_cell_length_b   5.06
_cell_length_c   5.82
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HNF2
_chemical_formula_sum   'H4 N4 F8'
_cell_volume   204.8
_cell_formula_units_Z   4
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
  H  H0  1  0.84  0.28  0.59  1.0
  H  H1  1  0.11  0.78  0.5  1.0
  H  H2  1  0.59  0.28  0.5  1.0
  H  H3  1  0.36  0.78  0.59  1.0
  N  N4  1  0.44  0.43  0.54  1.0
  N  N5  1  0.51  0.64  0.45  1.0
  N  N6  1  0.99  0.43  0.45  1.0
  N  N7  1  0.97  0.64  0.54  1.0
  F  F8  1  0.98  0.77  0.41  1.0
  F  F9  1  0.97  0.3  0.31  1.0
  F  F10  1  0.45  0.77  0.31  1.0
  F  F11  1  0.5  0.3  0.41  1.0
  F  F12  1  0.25  0.65  0.44  1.0
  F  F13  1  0.7  0.41  0.35  1.0
  F  F14  1  0.23  0.65  0.35  1.0
  F  F15  1  0.73  0.41  0.44  1.0

data_HNF2
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.06
_cell_length_b   5.82
_cell_length_c   6.95
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HNF2
_chemical_formula_sum   'H4 N4 F8'
_cell_volume   204.8
_cell_formula_units_Z   4
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
  H  H0  1  0.28  0.5  0.59  1.0
  H  H1  1  0.28  0.59  0.84  1.0
  H  H2  1  0.78  0.5  0.11  1.0
  H  H3  1  0.78  0.59  0.36  1.0
  N  N4  1  0.43  0.45  0.99  1.0
  N  N5  1  0.43  0.54  0.44  1.0
  N  N6  1  0.64  0.45  0.51  1.0
  N  N7  1  0.64  0.54  0.97  1.0
  F  F8  1  0.3  0.31  0.97  1.0
  F  F9  1  0.3  0.41  0.5  1.0
  F  F10  1  0.41  0.35  0.7  1.0
  F  F11  1  0.41  0.44  0.73  1.0
  F  F12  1  0.65  0.35  0.23  1.0
  F  F13  1  0.65  0.44  0.25  1.0
  F  F14  1  0.77  0.31  0.45  1.0
  F  F15  1  0.77  0.41  0.98  1.0

H H H H N N N N F F F F F F F F
H H H H N N N N F F F F F F F F 0 15 o o o 0 6 o o o 1 8 - o o 1 7 - o o 1 14 o o o 1 12 o o o 2 11 o o o 2 4 o o o 3 12 o o o 3 5 o o o 4 11 o o o 4 5 o o o 5 10 o o o 6 9 o o o 6 7 o o o 7 8 o o o 12 14 o o o 13 15 o o o 