# generated using pymatgen
data_LiEr(PO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.01452352
_cell_length_b   9.01452352
_cell_length_c   9.72554007
_cell_angle_alpha   57.78070469
_cell_angle_beta   57.78070469
_cell_angle_gamma   47.03539289
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiEr(PO3)4
_chemical_formula_sum   'Li2 Er2 P8 O24'
_cell_volume   470.51635315
_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  0.00000000  0.00000000  0.00000000  1
  Li  Li1  1  0.00000000  0.00000000  0.50000000  1
  Er  Er2  1  0.23529300  0.76470700  0.25000000  1
  Er  Er3  1  0.76470700  0.23529300  0.75000000  1
  P  P4  1  0.31738900  0.41346800  0.65633000  1
  P  P5  1  0.00931600  0.69201000  0.09139900  1
  P  P6  1  0.30799000  0.99068400  0.40860100  1
  P  P7  1  0.58653200  0.68261100  0.84367000  1
  P  P8  1  0.69201000  0.00931600  0.59139900  1
  P  P9  1  0.68261100  0.58653200  0.34367000  1
  P  P10  1  0.41346800  0.31738900  0.15633000  1
  P  P11  1  0.99068400  0.30799000  0.90860100  1
  O  O12  1  0.76124000  0.00728400  0.70534200  1
  O  O13  1  0.15221500  0.00819300  0.57970600  1
  O  O14  1  0.00819300  0.15221500  0.07970600  1
  O  O15  1  0.60578400  0.18589600  0.03733100  1
  O  O16  1  0.34753200  0.17068800  0.33114800  1
  O  O17  1  0.21807000  0.46092000  0.07815200  1
  O  O18  1  0.58165900  0.55548500  0.79400400  1
  O  O19  1  0.99180700  0.84778500  0.92029400  1
  O  O20  1  0.39421600  0.81410400  0.96266900  1
  O  O21  1  0.23876000  0.99271600  0.29465800  1
  O  O22  1  0.65246800  0.82931200  0.66885200  1
  O  O23  1  0.81410400  0.39421600  0.46266900  1
  O  O24  1  0.41834100  0.44451500  0.20599600  1
  O  O25  1  0.18589600  0.60578400  0.53733100  1
  O  O26  1  0.99271600  0.23876000  0.79465800  1
  O  O27  1  0.78193000  0.53908000  0.92184800  1
  O  O28  1  0.55548500  0.58165900  0.29400400  1
  O  O29  1  0.17068800  0.34753200  0.83114800  1
  O  O30  1  0.44451500  0.41834100  0.70599600  1
  O  O31  1  0.84778500  0.99180700  0.42029400  1
  O  O32  1  0.53908000  0.78193000  0.42184800  1
  O  O33  1  0.46092000  0.21807000  0.57815200  1
  O  O34  1  0.82931200  0.65246800  0.16885200  1
  O  O35  1  0.00728400  0.76124000  0.20534200  1
