# generated using pymatgen
data_LiCa2Co2N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.24653586
_cell_length_b   6.24653660
_cell_length_c   6.21059218
_cell_angle_alpha   88.45074780
_cell_angle_beta   88.45075292
_cell_angle_gamma   121.15708242
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCa2Co2N3
_chemical_formula_sum   'Li2 Ca4 Co4 N6'
_cell_volume   207.06214804
_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  0.81209308  0.18790692  0.75000000  1.0
  Li  Li1  1  0.18790692  0.81209308  0.25000000  1.0
  Ca  Ca2  1  0.81790197  0.68811461  0.90473602  1.0
  Ca  Ca3  1  0.31188539  0.18209803  0.59526398  1.0
  Ca  Ca4  1  0.18209803  0.31188539  0.09526398  1.0
  Ca  Ca5  1  0.68811461  0.81790197  0.40473602  1.0
  Co  Co6  1  0.57295017  0.16324640  0.10854094  1.0
  Co  Co7  1  0.42704983  0.83675360  0.89145906  1.0
  Co  Co8  1  0.83675360  0.42704983  0.39145906  1.0
  Co  Co9  1  0.16324640  0.57295017  0.60854094  1.0
  N  N10  1  0.41801853  0.58198147  0.75000000  1.0
  N  N11  1  0.58198147  0.41801853  0.25000000  1.0
  N  N12  1  0.99494525  0.72973784  0.52973138  1.0
  N  N13  1  0.72973784  0.99494525  0.02973138  1.0
  N  N14  1  0.00505475  0.27026216  0.47026862  1.0
  N  N15  1  0.27026216  0.00505475  0.97026862  1.0