# generated using pymatgen
data_NiNF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.49734885
_cell_length_b   5.49734885
_cell_length_c   14.22935100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001020
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiNF3
_chemical_formula_sum   'Ni6 N6 F18'
_cell_volume   372.41080548
_cell_formula_units_Z   6
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
  Ni  Ni0  1  0.00000000  0.00000000  0.50000000  1.0
  Ni  Ni1  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni2  1  0.33333300  0.66666700  0.65548000  1.0
  Ni  Ni3  1  0.66666700  0.33333300  0.34452000  1.0
  Ni  Ni4  1  0.66666700  0.33333300  0.15548000  1.0
  Ni  Ni5  1  0.33333300  0.66666700  0.84452000  1.0
  N  N6  1  0.00000000  0.00000000  0.25000000  1.0
  N  N7  1  0.00000000  0.00000000  0.75000000  1.0
  N  N8  1  0.33333300  0.66666700  0.40247500  1.0
  N  N9  1  0.66666700  0.33333300  0.59752500  1.0
  N  N10  1  0.66666700  0.33333300  0.90247500  1.0
  N  N11  1  0.33333300  0.66666700  0.09752500  1.0
  F  F12  1  0.51413100  0.48586900  0.25000000  1.0
  F  F13  1  0.51413100  0.02826100  0.25000000  1.0
  F  F14  1  0.97173900  0.48586900  0.25000000  1.0
  F  F15  1  0.48586900  0.51413100  0.75000000  1.0
  F  F16  1  0.48586900  0.97173900  0.75000000  1.0
  F  F17  1  0.02826100  0.51413100  0.75000000  1.0
  F  F18  1  0.83489500  0.16510500  0.42091400  1.0
  F  F19  1  0.83489500  0.66979100  0.42091400  1.0
  F  F20  1  0.33020900  0.16510500  0.42091400  1.0
  F  F21  1  0.16510500  0.83489500  0.57908600  1.0
  F  F22  1  0.16510500  0.33020900  0.57908600  1.0
  F  F23  1  0.66979100  0.83489500  0.57908600  1.0
  F  F24  1  0.16510500  0.83489500  0.92091400  1.0
  F  F25  1  0.16510500  0.33020900  0.92091400  1.0
  F  F26  1  0.66979100  0.83489500  0.92091400  1.0
  F  F27  1  0.83489500  0.16510500  0.07908600  1.0
  F  F28  1  0.83489500  0.66979100  0.07908600  1.0
  F  F29  1  0.33020900  0.16510500  0.07908600  1.0