# generated using pymatgen
data_Li2ErPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.73949800
_cell_length_b   4.90761600
_cell_length_c   9.08848462
_cell_angle_alpha   86.65094486
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2ErPCO7
_chemical_formula_sum   'Li4 Er2 P2 C2 O14'
_cell_volume   300.08705556
_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  0.51358400  0.79698200  0.79933100  1
  Li  Li1  1  0.98641600  0.79698200  0.79933100  1
  Li  Li2  1  0.48641600  0.20301800  0.20066900  1
  Li  Li3  1  0.01358400  0.20301800  0.20066900  1
  Er  Er4  1  0.25000000  0.25711200  0.63652900  1
  Er  Er5  1  0.75000000  0.74288800  0.36347100  1
  P  P6  1  0.75000000  0.27533600  0.59277700  1
  P  P7  1  0.25000000  0.72466400  0.40722300  1
  C  C8  1  0.25000000  0.25786300  0.93650300  1
  C  C9  1  0.75000000  0.74213700  0.06349700  1
  O  O10  1  0.75000000  0.72774800  0.92442300  1
  O  O11  1  0.25000000  0.02489400  0.87182100  1
  O  O12  1  0.25000000  0.47905200  0.84530000  1
  O  O13  1  0.93583600  0.14601500  0.66645100  1
  O  O14  1  0.56416400  0.14601500  0.66645100  1
  O  O15  1  0.25000000  0.76762700  0.57744600  1
  O  O16  1  0.75000000  0.59051900  0.60305300  1
  O  O17  1  0.25000000  0.40948100  0.39694700  1
  O  O18  1  0.75000000  0.23237300  0.42255400  1
  O  O19  1  0.43583600  0.85398500  0.33354900  1
  O  O20  1  0.06416400  0.85398500  0.33354900  1
  O  O21  1  0.75000000  0.52094800  0.15470000  1
  O  O22  1  0.75000000  0.97510600  0.12817900  1
  O  O23  1  0.25000000  0.27225200  0.07557700  1
