# generated using pymatgen
data_Li6Yb(PaN3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.08900644
_cell_length_b   6.08900762
_cell_length_c   5.42813454
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999897
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Yb(PaN3)2
_chemical_formula_sum   'Li6 Yb1 Pa2 N6'
_cell_volume   174.29069038
_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  0.98579701  0.66025616  0.60464702  1.0
  Li  Li1  1  0.33974384  0.32554085  0.60464702  1.0
  Li  Li2  1  0.67445915  0.01420299  0.60464702  1.0
  Li  Li3  1  0.01420299  0.33974384  0.39535298  1.0
  Li  Li4  1  0.66025616  0.67445915  0.39535298  1.0
  Li  Li5  1  0.32554085  0.98579701  0.39535298  1.0
  Yb  Yb6  1  0.00000000  0.00000000  0.00000000  1.0
  Pa  Pa7  1  0.33333300  0.66666700  0.99351428  1.0
  Pa  Pa8  1  0.66666700  0.33333300  0.00648572  1.0
  N  N9  1  0.00242899  0.64698389  0.22616686  1.0
  N  N10  1  0.35301611  0.35544510  0.22616686  1.0
  N  N11  1  0.64455490  0.99757101  0.22616686  1.0
  N  N12  1  0.99757101  0.35301611  0.77383314  1.0
  N  N13  1  0.64698389  0.64455490  0.77383314  1.0
  N  N14  1  0.35544510  0.00242899  0.77383314  1.0