# generated using pymatgen
data_LiCuPO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.94276200
_cell_length_b   9.82987800
_cell_length_c   14.00339800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCuPO4
_chemical_formula_sum   'Li8 Cu8 P8 O32'
_cell_volume   680.37956197
_cell_formula_units_Z   8
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  0.05253100  0.03322600  0.24818300  1
  Li  Li1  1  0.56138700  0.22016900  0.99681000  1
  Li  Li2  1  0.56138700  0.27983100  0.49681000  1
  Li  Li3  1  0.05253100  0.46677400  0.74818300  1
  Li  Li4  1  0.94746900  0.53322600  0.24818300  1
  Li  Li5  1  0.43861300  0.72016900  0.99681000  1
  Li  Li6  1  0.43861300  0.77983100  0.49681000  1
  Li  Li7  1  0.94746900  0.96677400  0.74818300  1
  Cu  Cu8  1  0.94553600  0.02559100  0.50009300  1
  Cu  Cu9  1  0.54455300  0.22738300  0.24730900  1
  Cu  Cu10  1  0.54455300  0.27261700  0.74730900  1
  Cu  Cu11  1  0.94553600  0.47440900  0.00009300  1
  Cu  Cu12  1  0.05446400  0.52559100  0.50009300  1
  Cu  Cu13  1  0.45544700  0.72738300  0.24730900  1
  Cu  Cu14  1  0.45544700  0.77261700  0.74730900  1
  Cu  Cu15  1  0.05446400  0.97440900  0.00009300  1
  P  P16  1  0.44122500  0.03243500  0.62348300  1
  P  P17  1  0.06869200  0.21470200  0.87278700  1
  P  P18  1  0.06869200  0.28529800  0.37278700  1
  P  P19  1  0.44122500  0.46756500  0.12348300  1
  P  P20  1  0.55877500  0.53243500  0.62348300  1
  P  P21  1  0.93130800  0.71470200  0.87278700  1
  P  P22  1  0.93130800  0.78529800  0.37278700  1
  P  P23  1  0.55877500  0.96756500  0.12348300  1
  O  O24  1  0.87169600  0.98958700  0.12381900  1
  O  O25  1  0.55941400  0.96660700  0.53184800  1
  O  O26  1  0.44203000  0.03227600  0.21566100  1
  O  O27  1  0.01810300  0.05785700  0.87389000  1
  O  O28  1  0.51228000  0.18634700  0.62225400  1
  O  O29  1  0.94349700  0.22515600  0.46526300  1
  O  O30  1  0.94263700  0.27411600  0.78057100  1
  O  O31  1  0.37670600  0.24666400  0.87242900  1
  O  O32  1  0.37670600  0.25333600  0.37242900  1
  O  O33  1  0.94263700  0.22588400  0.28057100  1
  O  O34  1  0.94349700  0.27484400  0.96526300  1
  O  O35  1  0.51228000  0.31365300  0.12225400  1
  O  O36  1  0.01810300  0.44214300  0.37389000  1
  O  O37  1  0.44203000  0.46772400  0.71566100  1
  O  O38  1  0.55941400  0.53339300  0.03184800  1
  O  O39  1  0.87169600  0.51041300  0.62381900  1
  O  O40  1  0.12830400  0.48958700  0.12381900  1
  O  O41  1  0.44058600  0.46660700  0.53184800  1
  O  O42  1  0.55797000  0.53227600  0.21566100  1
  O  O43  1  0.98189700  0.55785700  0.87389000  1
  O  O44  1  0.48772000  0.68634700  0.62225400  1
  O  O45  1  0.05650300  0.72515600  0.46526300  1
  O  O46  1  0.05736300  0.77411600  0.78057100  1
  O  O47  1  0.62329400  0.74666400  0.87242900  1
  O  O48  1  0.62329400  0.75333600  0.37242900  1
  O  O49  1  0.05736300  0.72588400  0.28057100  1
  O  O50  1  0.05650300  0.77484400  0.96526300  1
  O  O51  1  0.48772000  0.81365300  0.12225400  1
  O  O52  1  0.98189700  0.94214300  0.37389000  1
  O  O53  1  0.55797000  0.96772400  0.71566100  1
  O  O54  1  0.44058600  0.03339300  0.03184800  1
  O  O55  1  0.12830400  0.01041300  0.62381900  1
