# generated using pymatgen
data_Li6CrN4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.48530000
_cell_length_b   6.48530000
_cell_length_c   4.89418700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6CrN4
_chemical_formula_sum   'Li12 Cr2 N8'
_cell_volume   205.84517920
_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  0.60291400  1
  Li  Li1  1  0.00000000  0.50000000  0.89708600  1
  Li  Li2  1  0.00000000  0.50000000  0.39708600  1
  Li  Li3  1  0.50000000  0.00000000  0.10291400  1
  Li  Li4  1  0.21578200  0.21578200  0.50000000  1
  Li  Li5  1  0.78421800  0.78421800  0.50000000  1
  Li  Li6  1  0.71578200  0.71578200  0.00000000  1
  Li  Li7  1  0.28421800  0.28421800  0.00000000  1
  Li  Li8  1  0.21578200  0.78421800  0.50000000  1
  Li  Li9  1  0.78421800  0.21578200  0.50000000  1
  Li  Li10  1  0.71578200  0.28421800  0.00000000  1
  Li  Li11  1  0.28421800  0.71578200  0.00000000  1
  Cr  Cr12  1  0.50000000  0.50000000  0.50000000  1
  Cr  Cr13  1  0.00000000  0.00000000  0.00000000  1
  N  N14  1  0.50000000  0.26738300  0.31149000  1
  N  N15  1  0.50000000  0.73261700  0.31149000  1
  N  N16  1  0.00000000  0.76738300  0.18851000  1
  N  N17  1  0.00000000  0.23261700  0.18851000  1
  N  N18  1  0.26738300  0.50000000  0.68851000  1
  N  N19  1  0.73261700  0.50000000  0.68851000  1
  N  N20  1  0.76738300  0.00000000  0.81149000  1
  N  N21  1  0.23261700  0.00000000  0.81149000  1
