# generated using pymatgen
data_Li3Ni5OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.10352062
_cell_length_b   5.49247048
_cell_length_c   9.14332794
_cell_angle_alpha   85.70039406
_cell_angle_beta   72.80018954
_cell_angle_gamma   116.93064688
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ni5OF11
_chemical_formula_sum   'Li3 Ni5 O1 F11'
_cell_volume   211.61536826
_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
  Li  Li0  1  0.01950000  0.53303800  0.50051600  1
  Li  Li1  1  0.50367600  0.26519700  0.25858400  1
  Li  Li2  1  0.52800600  0.79325300  0.76742000  1
  Ni  Ni3  1  0.30884400  0.74776700  0.14908500  1
  Ni  Ni4  1  0.98278500  0.99182700  0.99669700  1
  Ni  Ni5  1  0.31333300  0.27636400  0.64771000  1
  Ni  Ni6  1  0.81001300  0.01438800  0.40715400  1
  Ni  Ni7  1  0.77827000  0.51048700  0.90349700  1
  O  O8  1  0.60267300  0.75569100  0.95716800  1
  F  F9  1  0.08754700  0.84235600  0.34883400  1
  F  F10  1  0.20397000  0.39938800  0.29916500  1
  F  F11  1  0.21575700  0.91675300  0.78943700  1
  F  F12  1  0.38715100  0.14792500  0.04344800  1
  F  F13  1  0.40958300  0.65783100  0.53901200  1
  F  F14  1  0.08145300  0.35009000  0.85183000  1
  F  F15  1  0.90385500  0.58925000  0.10470400  1
  F  F16  1  0.58547500  0.24170400  0.45223200  1
  F  F17  1  0.71041000  0.00398400  0.20679500  1
  F  F18  1  0.70437200  0.49224300  0.69894700  1
  F  F19  1  0.91309000  0.09486600  0.60264200  1
