# generated using pymatgen
data_Li6Zn3(PS4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.30843922
_cell_length_b   11.58476783
_cell_length_c   23.13710956
_cell_angle_alpha   89.89211178
_cell_angle_beta   89.91121234
_cell_angle_gamma   89.96546791
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Zn3(PS4)4
_chemical_formula_sum   'Li24 Zn12 P16 S64'
_cell_volume   2495.00796031
_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  0.74466799  0.50444916  0.87958011  1
  Li  Li1  1  0.74649305  0.99725266  0.87655704  1
  Li  Li2  1  0.24915784  0.75699445  0.75179457  1
  Li  Li3  1  0.24546044  0.75129002  0.00001578  1
  Li  Li4  1  0.50390238  0.49866957  0.25021830  1
  Li  Li5  1  0.50328582  0.99898002  0.25060844  1
  Li  Li6  1  0.50086884  0.50060245  0.49926566  1
  Li  Li7  1  0.50346098  0.00199091  0.49891907  1
  Li  Li8  1  0.00132057  0.75074800  0.37449903  1
  Li  Li9  1  0.00079298  0.25033353  0.37454100  1
  Li  Li10  1  0.49879987  0.49854194  0.74823207  1
  Li  Li11  1  0.50212386  0.00343082  0.74878480  1
  Li  Li12  1  0.99871550  0.75178153  0.62320236  1
  Li  Li13  1  0.00086368  0.25041456  0.62383195  1
  Li  Li14  1  0.49724952  0.49703058  0.00143913  1
  Li  Li15  1  0.49832229  0.00023360  0.00215117  1
  Li  Li16  1  0.99444997  0.74972866  0.87603077  1
  Li  Li17  1  0.99778099  0.75027730  0.12657960  1
  Li  Li18  1  0.00279204  0.24890072  0.12486200  1
  Li  Li19  1  0.48869360  0.25006093  0.87565870  1
  Li  Li20  1  0.49581988  0.75178344  0.87518524  1
  Li  Li21  1  0.99840278  0.00162978  0.74913228  1
  Li  Li22  1  0.99768007  0.50065518  0.00175970  1
  Li  Li23  1  0.00069401  0.00275517  0.00107750  1
  Zn  Zn24  1  0.01102188  0.24723544  0.87615101  1
  Zn  Zn25  1  0.50121762  0.24886668  0.12375013  1
  Zn  Zn26  1  0.50525544  0.74837873  0.12592733  1
  Zn  Zn27  1  0.49948568  0.24950714  0.37455987  1
  Zn  Zn28  1  0.49912625  0.74955539  0.37458444  1
  Zn  Zn29  1  -0.00000431  0.49966551  0.24973872  1
  Zn  Zn30  1  0.99982369  0.99929118  0.24941953  1
  Zn  Zn31  1  0.50137709  0.24906605  0.62617533  1
  Zn  Zn32  1  0.50605758  0.75180779  0.62323147  1
  Zn  Zn33  1  0.99880839  0.49917904  0.49918439  1
  Zn  Zn34  1  0.00016982  0.99963311  0.49961387  1
  Zn  Zn35  1  0.00111204  0.49886664  0.74927352  1
  P  P36  1  0.75038695  0.24972123  0.24981499  1
  P  P37  1  0.75054035  0.74988012  0.25040731  1
  P  P38  1  0.74987754  0.25058060  0.50013252  1
  P  P39  1  0.75040868  0.75007074  0.49965537  1
  P  P40  1  0.24997673  0.50014616  0.37508415  1
  P  P41  1  0.24978344  0.00020131  0.37500206  1
  P  P42  1  0.74980822  0.24299941  0.74854408  1
  P  P43  1  0.74934514  0.74385389  0.75205653  1
  P  P44  1  0.24754025  0.50056047  0.62521886  1
  P  P45  1  0.25339793  0.99546454  0.62435064  1
  P  P46  1  0.74943927  0.25896984  0.99924664  1
  P  P47  1  0.74976716  0.75417989  0.99966149  1
  P  P48  1  0.25097315  0.49726244  0.87240825  1
  P  P49  1  0.25005751  0.99831453  0.87686079  1
  P  P50  1  0.25375490  0.50461932  0.12579288  1
  P  P51  1  0.24812067  0.00365402  0.12553985  1
  S  S52  1  0.86922410  0.35704556  0.05184507  1
  S  S53  1  0.87129447  0.85475771  0.05128170  1
  S  S54  1  0.86414923  0.36143466  0.30214309  1
  S  S55  1  0.86442036  0.86145154  0.30256740  1
  S  S56  1  0.37092780  0.61158774  0.17904292  1
  S  S57  1  0.37388754  0.10755039  0.17727641  1
  S  S58  1  0.86371101  0.36234211  0.55235147  1
  S  S59  1  0.86242376  0.86225684  0.55204701  1
  S  S60  1  0.36359450  0.61172438  0.42745126  1
  S  S61  1  0.36359418  0.11175926  0.42732858  1
  S  S62  1  0.86998318  0.35740167  0.80378884  1
  S  S63  1  0.86856704  0.85419681  0.80207941  1
  S  S64  1  0.36806339  0.61308157  0.67673233  1
  S  S65  1  0.36381071  0.10910007  0.67693634  1
  S  S66  1  0.36344807  0.60436429  0.92663841  1
  S  S67  1  0.36984380  0.10074792  0.92794533  1
  S  S68  1  0.63614963  0.64535257  0.30640780  1
  S  S69  1  0.63680730  0.14537103  0.30628739  1
  S  S70  1  0.63852258  0.64381298  0.55574837  1
  S  S71  1  0.63575136  0.14634495  0.55624832  1
  S  S72  1  0.13589615  0.89518598  0.43097316  1
  S  S73  1  0.13657364  0.39499073  0.43123712  1
  S  S74  1  0.62575200  0.64006257  0.80403970  1
  S  S75  1  0.63149054  0.14525911  0.80465285  1
  S  S76  1  0.13296114  0.89328801  0.67850029  1
  S  S77  1  0.13714100  0.39457175  0.68124614  1
  S  S78  1  0.62646392  0.64728848  0.05216063  1
  S  S79  1  0.63343421  0.14769061  0.05131385  1
  S  S80  1  0.12531247  0.89228429  0.92805497  1
  S  S81  1  0.12637708  0.39559288  0.92610830  1
  S  S82  1  0.13788457  0.89564461  0.18151489  1
  S  S83  1  0.13617051  0.39907910  0.18025391  1
  S  S84  1  0.86468549  0.13830911  0.19776984  1
  S  S85  1  0.86326112  0.63778377  0.19824353  1
  S  S86  1  0.86450769  0.13910296  0.44809040  1
  S  S87  1  0.86551746  0.63920333  0.44752475  1
  S  S88  1  0.36428817  0.38878835  0.32290964  1
  S  S89  1  0.36421128  0.88863297  0.32293033  1
  S  S90  1  0.87023552  0.14372661  0.69674703  1
  S  S91  1  0.86920632  0.63903295  0.69786830  1
  S  S92  1  0.36727470  0.39130765  0.57444831  1
  S  S93  1  0.37134883  0.88856798  0.57107572  1
  S  S94  1  0.86799596  0.14639351  0.94464784  1
  S  S95  1  0.86639662  0.64273513  0.94752014  1
  S  S96  1  0.36697035  0.39496311  0.82002851  1
  S  S97  1  0.36743647  0.89573188  0.82046047  1
  S  S98  1  0.36385777  0.39019996  0.07350445  1
  S  S99  1  0.36874018  0.88837949  0.07418900  1
  S  S100  1  0.63599652  0.35324782  0.19388583  1
  S  S101  1  0.63791552  0.85480580  0.19453499  1
  S  S102  1  0.63502541  0.35417875  0.44428368  1
  S  S103  1  0.63513075  0.85357258  0.44407431  1
  S  S104  1  0.13500681  0.60404255  0.31953989  1
  S  S105  1  0.13506389  0.10395366  0.31929630  1
  S  S106  1  0.63395411  0.35418500  0.69662406  1
  S  S107  1  0.63333288  0.84955601  0.69677752  1
  S  S108  1  0.13424005  0.60433966  0.56946340  1
  S  S109  1  0.13630565  0.10052965  0.56975068  1
  S  S110  1  0.62672325  0.35897782  0.94482072  1
  S  S111  1  0.62585661  0.85792060  0.94653918  1
  S  S112  1  0.12560059  0.60713434  0.81946357  1
  S  S113  1  0.12905821  0.10491224  0.82279926  1
  S  S114  1  0.13404662  0.60721957  0.07171134  1
  S  S115  1  0.13874392  0.10588082  0.07096039  1
