# generated using pymatgen
data_Li6Tm2PaN6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.96320071
_cell_length_b   5.96320010
_cell_length_c   5.44127743
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000340
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Tm2PaN6
_chemical_formula_sum   'Li6 Tm2 Pa1 N6'
_cell_volume   167.56769527
_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  0.99728028  0.66256391  0.60799596  1.0
  Li  Li1  1  0.33743609  0.33471737  0.60799596  1.0
  Li  Li2  1  0.66528263  0.00271972  0.60799596  1.0
  Li  Li3  1  0.00271972  0.33743609  0.39200404  1.0
  Li  Li4  1  0.66256391  0.66528263  0.39200404  1.0
  Li  Li5  1  0.33471737  0.99728028  0.39200404  1.0
  Tm  Tm6  1  0.33333300  0.66666700  0.99829572  1.0
  Tm  Tm7  1  0.66666700  0.33333300  0.00170428  1.0
  Pa  Pa8  1  0.00000000  0.00000000  0.00000000  1.0
  N  N9  1  0.99997054  0.67569311  0.22838925  1.0
  N  N10  1  0.32430689  0.32427843  0.22838925  1.0
  N  N11  1  0.67572157  0.00002946  0.22838925  1.0
  N  N12  1  0.00002946  0.32430689  0.77161075  1.0
  N  N13  1  0.67569311  0.67572157  0.77161075  1.0
  N  N14  1  0.32427843  0.99997054  0.77161075  1.0