# generated using pymatgen
data_LiPO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.52155800
_cell_length_b   13.31298000
_cell_length_c   19.66463186
_cell_angle_alpha   57.25981679
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiPO3
_chemical_formula_sum   'Li20 P20 O60'
_cell_volume   1215.86885290
_cell_formula_units_Z   20
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  0.50539300  0.87352200  0.18178000  1
  Li  Li1  1  0.49460700  0.87352200  0.68178000  1
  Li  Li2  1  0.51558100  0.11117000  0.06599600  1
  Li  Li3  1  0.48441900  0.11117000  0.56599600  1
  Li  Li4  1  0.49421600  0.34704300  0.95054300  1
  Li  Li5  1  0.50578400  0.34704300  0.45054300  1
  Li  Li6  1  0.49277600  0.58170300  0.83545200  1
  Li  Li7  1  0.50722400  0.58170300  0.33545200  1
  Li  Li8  1  0.00721700  0.72910600  0.75843400  1
  Li  Li9  1  0.99278300  0.72910600  0.25843400  1
  Li  Li10  1  0.47880600  0.37573700  0.68171400  1
  Li  Li11  1  0.52119400  0.37573700  0.18171400  1
  Li  Li12  1  0.52368700  0.61227500  0.56627000  1
  Li  Li13  1  0.47631300  0.61227500  0.06627000  1
  Li  Li14  1  0.46675000  0.84818200  0.44954700  1
  Li  Li15  1  0.53325000  0.84818200  0.94954700  1
  Li  Li16  1  0.52226300  0.08452000  0.33298400  1
  Li  Li17  1  0.47773700  0.08452000  0.83298400  1
  Li  Li18  1  0.03911100  0.23317100  0.25636600  1
  Li  Li19  1  0.96088900  0.23317100  0.75636600  1
  P  P20  1  0.81462300  0.99922100  0.99958700  1
  P  P21  1  0.18537700  0.99922100  0.49958700  1
  P  P22  1  0.15668300  0.20561300  0.90672000  1
  P  P23  1  0.84331700  0.20561300  0.40672000  1
  P  P24  1  0.81155600  0.40113700  0.80293900  1
  P  P25  1  0.18844400  0.40113700  0.30293900  1
  P  P26  1  0.17102300  0.59160500  0.69168900  1
  P  P27  1  0.82897700  0.59160500  0.19168900  1
  P  P28  1  0.84026100  0.79159900  0.59175100  1
  P  P29  1  0.15973900  0.79159900  0.09175100  1
  P  P30  1  0.15607000  0.66508000  0.42543300  1
  P  P31  1  0.84393000  0.66508000  0.92543300  1
  P  P32  1  0.82567800  0.86545200  0.32556200  1
  P  P33  1  0.17432200  0.86545200  0.82556200  1
  P  P34  1  0.18772200  0.05632300  0.21354500  1
  P  P35  1  0.81227800  0.05632300  0.71354500  1
  P  P36  1  0.84809900  0.25213400  0.11014400  1
  P  P37  1  0.15190100  0.25213400  0.61014400  1
  P  P38  1  0.19013300  0.45842000  0.01715500  1
  P  P39  1  0.80986700  0.45842000  0.51715500  1
  O  O40  1  0.93100000  0.12998500  0.96458700  1
  O  O41  1  0.06900000  0.12998500  0.46458700  1
  O  O42  1  0.04891300  0.34017900  0.85937200  1
  O  O43  1  0.95108700  0.34017900  0.35937200  1
  O  O44  1  0.91998200  0.51865000  0.72414400  1
  O  O45  1  0.08001800  0.51865000  0.22414400  1
  O  O46  1  0.07331900  0.70690400  0.60774100  1
  O  O47  1  0.92668100  0.70690400  0.10774100  1
  O  O48  1  0.05797800  0.91984800  0.02185200  1
  O  O49  1  0.94202200  0.91984800  0.52185200  1
  O  O50  1  0.92321900  0.74993600  0.40937800  1
  O  O51  1  0.07678100  0.74993600  0.90937800  1
  O  O52  1  0.07815900  0.93677400  0.29059600  1
  O  O53  1  0.92184100  0.93677400  0.79059600  1
  O  O54  1  0.95073500  0.11679900  0.15644500  1
  O  O55  1  0.04926500  0.11679900  0.65644500  1
  O  O56  1  0.08121300  0.32543200  0.05652000  1
  O  O57  1  0.91878700  0.32543200  0.55652000  1
  O  O58  1  0.05530900  0.53637100  0.49567300  1
  O  O59  1  0.94469100  0.53637100  0.99567300  1
  O  O60  1  0.67720500  0.97082700  0.07388900  1
  O  O61  1  0.32279500  0.97082700  0.57388900  1
  O  O62  1  0.68608200  0.99490900  0.93392600  1
  O  O63  1  0.31391800  0.99490900  0.43392600  1
  O  O64  1  0.35642400  0.20462500  0.95865100  1
  O  O65  1  0.64357600  0.20462500  0.45865100  1
  O  O66  1  0.20469500  0.17105600  0.84674300  1
  O  O67  1  0.79530500  0.17105600  0.34674300  1
  O  O68  1  0.64802600  0.43965800  0.84535300  1
  O  O69  1  0.35197400  0.43965800  0.34535300  1
  O  O70  1  0.71821900  0.32258300  0.77541000  1
  O  O71  1  0.28178100  0.32258300  0.27541000  1
  O  O72  1  0.24845400  0.63067000  0.74729500  1
  O  O73  1  0.75154600  0.63067000  0.24729500  1
  O  O74  1  0.34371000  0.52752000  0.66935200  1
  O  O75  1  0.65629000  0.52752000  0.16935200  1
  O  O76  1  0.78487900  0.79058400  0.66715900  1
  O  O77  1  0.21512100  0.79058400  0.16715900  1
  O  O78  1  0.64422300  0.76110500  0.55329200  1
  O  O79  1  0.35577700  0.76110500  0.05329200  1
  O  O80  1  0.35011000  0.69760900  0.46333500  1
  O  O81  1  0.64989000  0.69760900  0.96333500  1
  O  O82  1  0.21400400  0.66508700  0.35060600  1
  O  O83  1  0.78599600  0.66508700  0.85060600  1
  O  O84  1  0.65920700  0.93140600  0.34821500  1
  O  O85  1  0.34079300  0.93140600  0.84821500  1
  O  O86  1  0.74195600  0.82468800  0.27145800  1
  O  O87  1  0.25804400  0.82468800  0.77145800  1
  O  O88  1  0.27426600  0.13528000  0.24162500  1
  O  O89  1  0.72573400  0.13528000  0.74162500  1
  O  O90  1  0.35705000  0.01988000  0.17119900  1
  O  O91  1  0.64295000  0.01988000  0.67119900  1
  O  O92  1  0.79472800  0.28638000  0.17002700  1
  O  O93  1  0.20527200  0.28638000  0.67002700  1
  O  O94  1  0.65270500  0.25700400  0.05564000  1
  O  O95  1  0.34729500  0.25700400  0.55564000  1
  O  O96  1  0.32253000  0.46718100  0.08044100  1
  O  O97  1  0.67747000  0.46718100  0.58044100  1
  O  O98  1  0.32108600  0.48469000  0.94236600  1
  O  O99  1  0.67891400  0.48469000  0.44236600  1
