# generated using pymatgen
data_Li12Ca6Hg4N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.69033531
_cell_length_b   8.69033604
_cell_length_c   8.69033507
_cell_angle_alpha   109.47121836
_cell_angle_beta   109.47122006
_cell_angle_gamma   109.47122274
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li12Ca6Hg4N
_chemical_formula_sum   'Li12 Ca6 Hg4 N1'
_cell_volume   505.22838120
_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  0.67633208  0.33816654  0.33816654  1.0
  Li  Li1  1  0.33816654  0.00000000  0.66183346  1.0
  Li  Li2  1  0.33816654  0.67633208  0.33816654  1.0
  Li  Li3  1  0.33816654  0.33816654  0.67633208  1.0
  Li  Li4  1  0.33816654  0.66183346  0.00000000  1.0
  Li  Li5  1  1.00000000  0.33816654  0.66183346  1.0
  Li  Li6  1  0.00000000  0.66183346  0.33816654  1.0
  Li  Li7  1  0.66183346  0.66183346  0.32366792  1.0
  Li  Li8  1  0.66183346  1.00000000  0.33816654  1.0
  Li  Li9  1  0.66183346  0.33816654  1.00000000  1.0
  Li  Li10  1  0.66183346  0.32366792  0.66183346  1.0
  Li  Li11  1  0.32366792  0.66183346  0.66183346  1.0
  Ca  Ca12  1  1.00000000  0.24214359  0.24214359  1.0
  Ca  Ca13  1  0.24214359  0.00000000  0.24214359  1.0
  Ca  Ca14  1  0.75785641  1.00000000  0.75785641  1.0
  Ca  Ca15  1  0.75785641  0.75785641  0.00000000  1.0
  Ca  Ca16  1  0.24214359  0.24214359  1.00000000  1.0
  Ca  Ca17  1  0.00000000  0.75785641  0.75785641  1.0
  Hg  Hg18  1  0.50000000  0.50000000  0.50000000  1.0
  Hg  Hg19  1  0.50000000  0.00000000  0.00000000  1.0
  Hg  Hg20  1  0.00000000  0.50000000  0.00000000  1.0
  Hg  Hg21  1  0.00000000  0.00000000  0.50000000  1.0
  N  N22  1  0.00000000  0.00000000  0.00000000  1.0