# generated using pymatgen
data_LiNb5As4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.03440772
_cell_length_b   10.03440772
_cell_length_c   3.50915636
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNb5As4
_chemical_formula_sum   'Li2 Nb10 As8'
_cell_volume   353.33463239
_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  0.50000000  0.00000000  0.50000000  1.0
  Li  Li1  1  0.00000000  0.50000000  0.50000000  1.0
  Nb  Nb2  1  0.18949322  0.13502079  0.50000000  1.0
  Nb  Nb3  1  0.13502079  0.81050678  0.50000000  1.0
  Nb  Nb4  1  0.86497921  0.18949322  0.50000000  1.0
  Nb  Nb5  1  0.81050678  0.86497921  0.50000000  1.0
  Nb  Nb6  1  0.29658122  0.37776875  0.00000000  1.0
  Nb  Nb7  1  0.37776875  0.70341878  0.00000000  1.0
  Nb  Nb8  1  0.62223125  0.29658122  0.00000000  1.0
  Nb  Nb9  1  0.70341878  0.62223125  0.00000000  1.0
  Nb  Nb10  1  0.50000000  0.50000000  0.50000000  1.0
  Nb  Nb11  1  0.00000000  0.00000000  0.00000000  1.0
  As  As12  1  0.43148746  0.23507844  0.50000000  1.0
  As  As13  1  0.23507844  0.56851254  0.50000000  1.0
  As  As14  1  0.76492156  0.43148746  0.50000000  1.0
  As  As15  1  0.56851254  0.76492156  0.50000000  1.0
  As  As16  1  0.04768674  0.27839272  0.00000000  1.0
  As  As17  1  0.27839272  0.95231326  0.00000000  1.0
  As  As18  1  0.72160728  0.04768674  0.00000000  1.0
  As  As19  1  0.95231326  0.72160728  0.00000000  1.0