# generated using pymatgen
data_Li2Ca(NiN)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.02105523
_cell_length_b   7.02105523
_cell_length_c   3.49364877
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Ca(NiN)2
_chemical_formula_sum   'Li4 Ca2 Ni4 N4'
_cell_volume   172.22017266
_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  0.11478015  0.61478015  0.00000000  1.0
  Li  Li1  1  0.88521985  0.38521985  0.00000000  1.0
  Li  Li2  1  0.61478015  0.88521985  0.00000000  1.0
  Li  Li3  1  0.38521985  0.11478015  0.00000000  1.0
  Ca  Ca4  1  0.00000000  0.00000000  0.00000000  1.0
  Ca  Ca5  1  0.50000000  0.50000000  0.00000000  1.0
  Ni  Ni6  1  0.67967761  0.17967761  0.50000000  1.0
  Ni  Ni7  1  0.32032239  0.82032239  0.50000000  1.0
  Ni  Ni8  1  0.17967761  0.32032239  0.50000000  1.0
  Ni  Ni9  1  0.82032239  0.67967761  0.50000000  1.0
  N  N10  1  0.67806171  0.17806171  0.00000000  1.0
  N  N11  1  0.32193829  0.82193829  0.00000000  1.0
  N  N12  1  0.17806171  0.32193829  0.00000000  1.0
  N  N13  1  0.82193829  0.67806171  0.00000000  1.0