# generated using pymatgen
data_Li3Ni3OF7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.01978701
_cell_length_b   6.01501727
_cell_length_c   10.33760869
_cell_angle_alpha   90.00114566
_cell_angle_beta   73.02439260
_cell_angle_gamma   119.97241743
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ni3OF7
_chemical_formula_sum   'Li6 Ni6 O2 F14'
_cell_volume   305.28640529
_cell_formula_units_Z   2
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  0.99939700  0.99970100  0.00103200  1
  Li  Li1  1  0.99939900  0.49970600  0.50102800  1
  Li  Li2  1  0.74266600  0.87134800  0.38601500  1
  Li  Li3  1  0.74271000  0.37135900  0.88596300  1
  Li  Li4  1  0.37579300  0.68789000  0.93619500  1
  Li  Li5  1  0.37578500  0.18788500  0.43618900  1
  Ni  Ni6  1  0.38511900  0.43315700  0.18177300  1
  Ni  Ni7  1  0.38514400  0.95202400  0.18176200  1
  Ni  Ni8  1  0.86646000  0.43324900  0.18191600  1
  Ni  Ni9  1  0.38509200  0.93299900  0.68180400  1
  Ni  Ni10  1  0.38531000  0.45204800  0.68171600  1
  Ni  Ni11  1  0.86612200  0.93306800  0.68183000  1
  O  O12  1  0.61407200  0.80706200  0.57974100  1
  O  O13  1  0.61414600  0.30708400  0.07967400  1
  F  F14  1  0.13515000  0.56758200  0.29591200  1
  F  F15  1  0.13516200  0.06758400  0.79591700  1
  F  F16  1  0.14435100  0.57216000  0.81010500  1
  F  F17  1  0.14437000  0.07218800  0.31012900  1
  F  F18  1  0.61673400  0.57198600  0.81048500  1
  F  F19  1  0.61653700  0.07180900  0.31052000  1
  F  F20  1  0.61663300  0.04472500  0.81050500  1
  F  F21  1  0.61653800  0.54473900  0.31052100  1
  F  F22  1  0.13282100  0.33088700  0.06642600  1
  F  F23  1  0.13280800  0.83088500  0.56639100  1
  F  F24  1  0.13282200  0.80194200  0.06643000  1
  F  F25  1  0.13283100  0.30193400  0.56643000  1
  F  F26  1  0.60301400  0.80151200  0.06680200  1
  F  F27  1  0.60301100  0.30148900  0.56679600  1
