# generated using pymatgen
data_Li6Zn3(PS4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.31568385
_cell_length_b   11.61084580
_cell_length_c   23.12878669
_cell_angle_alpha   89.97098903
_cell_angle_beta   90.03646800
_cell_angle_gamma   89.91780292
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Zn3(PS4)4
_chemical_formula_sum   'Li24 Zn12 P16 S64'
_cell_volume   2501.67482876
_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  0.74884475  0.49581761  0.87485285  1
  Li  Li1  1  0.74275526  0.00307012  0.87521164  1
  Li  Li2  1  0.24879855  0.74231336  0.75400361  1
  Li  Li3  1  0.24928057  0.73989904  0.99738578  1
  Li  Li4  1  0.50488769  0.49806341  0.25114868  1
  Li  Li5  1  0.50120258  0.00006946  0.25037839  1
  Li  Li6  1  0.50457708  0.50179724  0.49865686  1
  Li  Li7  1  0.50213879  0.00070042  0.49990011  1
  Li  Li8  1  0.00204582  0.74957589  0.37517215  1
  Li  Li9  1  0.00134213  0.25046298  0.37500709  1
  Li  Li10  1  0.50354650  0.49891221  0.74741997  1
  Li  Li11  1  0.49433601  0.00231350  0.74933363  1
  Li  Li12  1  0.99689724  0.74969604  0.62160902  1
  Li  Li13  1  0.00486663  0.25289991  0.62536952  1
  Li  Li14  1  0.50233813  0.49581616  0.00052991  1
  Li  Li15  1  0.49404374  0.00357583  0.00147012  1
  Li  Li16  1  0.99354040  0.74937684  0.87404533  1
  Li  Li17  1  0.01076784  0.25165767  0.87605108  1
  Li  Li18  1  0.99850086  0.74821053  0.12741890  1
  Li  Li19  1  0.00280269  0.24964984  0.12588010  1
  Li  Li20  1  0.48326086  0.25175604  0.87440599  1
  Li  Li21  1  0.50094244  0.74887645  0.87557577  1
  Li  Li22  1  0.00005498  0.49717166  0.75013477  1
  Li  Li23  1  0.99968559  0.49790384  0.00140146  1
  Zn  Zn24  1  0.49965751  0.25117594  0.12379107  1
  Zn  Zn25  1  0.50676040  0.74818345  0.12665887  1
  Zn  Zn26  1  0.49911053  0.24989506  0.37507099  1
  Zn  Zn27  1  0.49811889  0.75000695  0.37497227  1
  Zn  Zn28  1  0.99973320  0.49982985  0.25019261  1
  Zn  Zn29  1  0.99850098  0.00042551  0.25038391  1
  Zn  Zn30  1  0.50072330  0.25095909  0.62527417  1
  Zn  Zn31  1  0.50504806  0.75064100  0.62401399  1
  Zn  Zn32  1  0.99963163  0.50027803  0.50041637  1
  Zn  Zn33  1  0.99884510  0.99961579  0.49915297  1
  Zn  Zn34  1  0.99846686  0.00215610  0.74900643  1
  Zn  Zn35  1  0.99831742  0.00157808  0.00080733  1
  P  P36  1  0.74983748  0.24945501  0.24994093  1
  P  P37  1  0.75058857  0.75015135  0.25060137  1
  P  P38  1  0.75038298  0.25017269  0.50007756  1
  P  P39  1  0.75016134  0.75053268  0.49932710  1
  P  P40  1  0.24965585  0.49990750  0.37505038  1
  P  P41  1  0.25006182  0.00008356  0.37491678  1
  P  P42  1  0.74918200  0.24308875  0.75274714  1
  P  P43  1  0.75000338  0.74760994  0.74790749  1
  P  P44  1  0.24931664  0.49679479  0.62423775  1
  P  P45  1  0.25222264  0.99875364  0.62457745  1
  P  P46  1  0.74958610  0.25288597  0.00186709  1
  P  P47  1  0.74960096  0.75690041  0.99797192  1
  P  P48  1  0.25036637  0.50548169  0.87503948  1
  P  P49  1  0.24853735  0.99523586  0.87461285  1
  P  P50  1  0.25409596  0.50562314  0.12610059  1
  P  P51  1  0.24793335  0.99910711  0.12473682  1
  S  S52  1  0.86956279  0.35402130  0.05336524  1
  S  S53  1  0.87106600  0.85953307  0.05230557  1
  S  S54  1  0.86427575  0.36095578  0.30203832  1
  S  S55  1  0.86591100  0.86089027  0.30266595  1
  S  S56  1  0.37286272  0.61190961  0.17936147  1
  S  S57  1  0.36648962  0.10852043  0.17583454  1
  S  S58  1  0.86426965  0.36151410  0.55231396  1
  S  S59  1  0.86206143  0.86337088  0.55143648  1
  S  S60  1  0.36374943  0.61163734  0.42711414  1
  S  S61  1  0.36399220  0.11132029  0.42724736  1
  S  S62  1  0.86852470  0.35170376  0.80356520  1
  S  S63  1  0.86557425  0.86236216  0.80147239  1
  S  S64  1  0.36953160  0.61181941  0.67580545  1
  S  S65  1  0.36220222  0.11130026  0.67674739  1
  S  S66  1  0.37322011  0.60919681  0.92931124  1
  S  S67  1  0.36262307  0.10114734  0.92615004  1
  S  S68  1  0.63574844  0.64668740  0.30637714  1
  S  S69  1  0.63582940  0.14560590  0.30602932  1
  S  S70  1  0.63826656  0.64568861  0.55540452  1
  S  S71  1  0.63624297  0.14601365  0.55582373  1
  S  S72  1  0.13624625  0.89566309  0.43072276  1
  S  S73  1  0.13534144  0.39612309  0.43087337  1
  S  S74  1  0.63169004  0.64554078  0.80253642  1
  S  S75  1  0.62493860  0.14098484  0.80507025  1
  S  S76  1  0.13193829  0.89361684  0.68002125  1
  S  S77  1  0.14006322  0.39540933  0.67916437  1
  S  S78  1  0.63269299  0.65139060  0.05277720  1
  S  S79  1  0.62985416  0.14525195  0.05438288  1
  S  S80  1  0.12354680  0.89073604  0.92964604  1
  S  S81  1  0.12749020  0.40317902  0.92628614  1
  S  S82  1  0.13434727  0.89572936  0.18067894  1
  S  S83  1  0.13750329  0.40014500  0.18071157  1
  S  S84  1  0.86411632  0.13786370  0.19777626  1
  S  S85  1  0.86197069  0.63741611  0.19829257  1
  S  S86  1  0.86495827  0.13910223  0.44762604  1
  S  S87  1  0.86494973  0.63904468  0.44747789  1
  S  S88  1  0.36385022  0.38834150  0.32284599  1
  S  S89  1  0.36385664  0.88866563  0.32256934  1
  S  S90  1  0.86756079  0.13940505  0.69759242  1
  S  S91  1  0.87501166  0.64757067  0.69750898  1
  S  S92  1  0.37494189  0.39315038  0.57217958  1
  S  S93  1  0.36505478  0.88747310  0.57227887  1
  S  S94  1  0.86822117  0.13985682  0.94789594  1
  S  S95  1  0.86734494  0.64566186  0.94775524  1
  S  S96  1  0.37444512  0.40554702  0.82302505  1
  S  S97  1  0.36624856  0.88832771  0.82194671  1
  S  S98  1  0.36394033  0.39203170  0.07344912  1
  S  S99  1  0.36799285  0.88618871  0.07342319  1
  S  S100  1  0.63481904  0.35293759  0.19417302  1
  S  S101  1  0.63890442  0.85597885  0.19455654  1
  S  S102  1  0.63654284  0.35383860  0.44372046  1
  S  S103  1  0.63438577  0.85419395  0.44372836  1
  S  S104  1  0.13527258  0.60417052  0.31924009  1
  S  S105  1  0.13572057  0.10430362  0.31904695  1
  S  S106  1  0.63563642  0.34822477  0.69658731  1
  S  S107  1  0.62755741  0.85503571  0.69603007  1
  S  S108  1  0.13873001  0.60411468  0.56811311  1
  S  S109  1  0.13289174  0.10099858  0.56999047  1
  S  S110  1  0.63090715  0.35130776  0.94568252  1
  S  S111  1  0.62666459  0.86206598  0.94634794  1
  S  S112  1  0.12639071  0.61033265  0.82167311  1
  S  S113  1  0.12637745  0.09980162  0.82157126  1
  S  S114  1  0.13292698  0.60763137  0.07239642  1
  S  S115  1  0.13824904  0.10433863  0.06844111  1
