# generated using pymatgen
data_Li3Sc2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.91933600
_cell_length_b   8.93730000
_cell_length_c   15.25646322
_cell_angle_alpha   54.66075108
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Sc2(PO4)3
_chemical_formula_sum   'Li12 Sc8 P12 O48'
_cell_volume   992.07684301
_cell_formula_units_Z   4
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  0.76898800  0.01286300  0.17876700  1
  Li  Li1  1  0.27374400  0.60352600  0.17740100  1
  Li  Li2  1  0.91057000  0.23897800  0.21165900  1
  Li  Li3  1  0.41057000  0.76102200  0.28834100  1
  Li  Li4  1  0.77374400  0.39647400  0.32259900  1
  Li  Li5  1  0.26898800  0.98713700  0.32123300  1
  Li  Li6  1  0.22625600  0.60352600  0.67740100  1
  Li  Li7  1  0.73101200  0.01286300  0.67876700  1
  Li  Li8  1  0.58943000  0.23897800  0.71165900  1
  Li  Li9  1  0.08943000  0.76102200  0.78834100  1
  Li  Li10  1  0.72625600  0.39647400  0.82259900  1
  Li  Li11  1  0.23101200  0.98713700  0.82123300  1
  Sc  Sc12  1  0.45633100  0.15468500  0.10630300  1
  Sc  Sc13  1  0.95461600  0.64636700  0.11071800  1
  Sc  Sc14  1  0.45461600  0.35363300  0.38928200  1
  Sc  Sc15  1  0.95633100  0.84531500  0.39369700  1
  Sc  Sc16  1  0.54538400  0.64636700  0.61071800  1
  Sc  Sc17  1  0.04366900  0.15468500  0.60630300  1
  Sc  Sc18  1  0.04538400  0.35363300  0.88928200  1
  Sc  Sc19  1  0.54366900  0.84531500  0.89369700  1
  P  P20  1  0.24568700  0.55194300  0.99786500  1
  P  P21  1  0.75431300  0.44805700  0.00213500  1
  P  P22  1  0.10626100  0.95420000  0.15108300  1
  P  P23  1  0.60047800  0.74583100  0.15083100  1
  P  P24  1  0.60626100  0.04580000  0.34891700  1
  P  P25  1  0.10047800  0.25416900  0.34916900  1
  P  P26  1  0.74568700  0.44805700  0.50213500  1
  P  P27  1  0.25431300  0.55194300  0.49786500  1
  P  P28  1  0.89952200  0.74583100  0.65083100  1
  P  P29  1  0.39373900  0.95420000  0.65108300  1
  P  P30  1  0.39952200  0.25416900  0.84916900  1
  P  P31  1  0.89373900  0.04580000  0.84891700  1
  O  O32  1  0.08088500  0.11950600  0.03397200  1
  O  O33  1  0.56726400  0.81347900  0.03460100  1
  O  O34  1  0.86206400  0.46905700  0.07410200  1
  O  O35  1  0.35167700  0.38709300  0.06212000  1
  O  O36  1  0.16023700  0.57362900  0.07837100  1
  O  O37  1  0.66864100  0.26441800  0.07981500  1
  O  O38  1  0.59570200  0.90566200  0.16436700  1
  O  O39  1  0.10143600  0.77113000  0.16168900  1
  O  O40  1  0.26462600  0.96922000  0.19043500  1
  O  O41  1  0.75506500  0.64972000  0.18608700  1
  O  O42  1  0.98112800  0.95990500  0.22071800  1
  O  O43  1  0.47294200  0.61333700  0.22715900  1
  O  O44  1  0.97294200  0.38666300  0.27284100  1
  O  O45  1  0.48112800  0.04009500  0.27928200  1
  O  O46  1  0.76462600  0.03078000  0.30956500  1
  O  O47  1  0.25506500  0.35028000  0.31391300  1
  O  O48  1  0.09570200  0.09433800  0.33563300  1
  O  O49  1  0.60143600  0.22887000  0.33831100  1
  O  O50  1  0.66023700  0.42637100  0.42162900  1
  O  O51  1  0.16864100  0.73558200  0.42018500  1
  O  O52  1  0.85167700  0.61290700  0.43788000  1
  O  O53  1  0.36206400  0.53094300  0.42589800  1
  O  O54  1  0.06726400  0.18652100  0.46539900  1
  O  O55  1  0.58088500  0.88049400  0.46602800  1
  O  O56  1  0.41911500  0.11950600  0.53397200  1
  O  O57  1  0.93273600  0.81347900  0.53460100  1
  O  O58  1  0.63793600  0.46905700  0.57410200  1
  O  O59  1  0.14832300  0.38709300  0.56212000  1
  O  O60  1  0.33976300  0.57362900  0.57837100  1
  O  O61  1  0.83135900  0.26441800  0.57981500  1
  O  O62  1  0.39856400  0.77113000  0.66168900  1
  O  O63  1  0.90429800  0.90566200  0.66436700  1
  O  O64  1  0.74493500  0.64972000  0.68608700  1
  O  O65  1  0.23537400  0.96922000  0.69043500  1
  O  O66  1  0.02705800  0.61333700  0.72715900  1
  O  O67  1  0.51887200  0.95990500  0.72071800  1
  O  O68  1  0.52705800  0.38666300  0.77284100  1
  O  O69  1  0.01887200  0.04009500  0.77928200  1
  O  O70  1  0.24493500  0.35028000  0.81391300  1
  O  O71  1  0.73537400  0.03078000  0.80956500  1
  O  O72  1  0.89856400  0.22887000  0.83831100  1
  O  O73  1  0.40429800  0.09433800  0.83563300  1
  O  O74  1  0.83976300  0.42637100  0.92162900  1
  O  O75  1  0.33135900  0.73558200  0.92018500  1
  O  O76  1  0.13793600  0.53094300  0.92589800  1
  O  O77  1  0.64832300  0.61290700  0.93788000  1
  O  O78  1  0.43273600  0.18652100  0.96539900  1
  O  O79  1  0.91911500  0.88049400  0.96602800  1
