# generated using pymatgen
data_LiZnCr3(SO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.30795300
_cell_length_b   8.88456919
_cell_length_c   14.36136361
_cell_angle_alpha   105.44308743
_cell_angle_beta   90.06619908
_cell_angle_gamma   117.69944412
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiZnCr3(SO4)6
_chemical_formula_sum   'Li2 Zn2 Cr6 S12 O48'
_cell_volume   894.93337640
_cell_formula_units_Z   2
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  0.36031200  0.18720800  0.58975700  1
  Li  Li1  1  0.80624400  0.60635100  0.38269600  1
  Zn  Zn2  1  0.28514000  0.71269300  0.42419600  1
  Zn  Zn3  1  0.74335300  0.29376900  0.58525300  1
  Cr  Cr4  1  0.77328200  0.69657800  0.92520400  1
  Cr  Cr5  1  0.46715200  0.28414500  0.82622900  1
  Cr  Cr6  1  0.96800500  0.29560400  0.31839600  1
  Cr  Cr7  1  0.02813800  0.69782500  0.68161000  1
  Cr  Cr8  1  0.53179400  0.71417100  0.17432700  1
  Cr  Cr9  1  0.23004800  0.30681000  0.07504600  1
  S  S10  1  0.02865900  0.20533200  0.77494900  1
  S  S11  1  0.58211100  0.49200900  0.63074900  1
  S  S12  1  0.51723600  0.79060000  0.97832200  1
  S  S13  1  0.98324900  0.20662400  0.51799400  1
  S  S14  1  0.91422300  0.50179700  0.87576700  1
  S  S15  1  0.52457300  0.22245300  0.26426800  1
  S  S16  1  0.47954400  0.78195600  0.73457000  1
  S  S17  1  0.08648500  0.50004900  0.12391900  1
  S  S18  1  0.01968200  0.79407400  0.47964800  1
  S  S19  1  0.48492200  0.21016700  0.02263500  1
  S  S20  1  0.40934900  0.50668800  0.37100400  1
  S  S21  1  0.97612400  0.79205200  0.22786700  1
  O  O22  1  0.43628100  0.58013100  0.74981800  1
  O  O23  1  0.43677600  0.18841100  0.94813600  1
  O  O24  1  0.88537200  0.02488100  0.83979600  1
  O  O25  1  0.74015800  0.37278200  0.85555600  1
  O  O26  1  0.97532200  0.25797400  0.67970600  1
  O  O27  1  0.20197400  0.13475900  0.82293800  1
  O  O28  1  0.45046400  0.38799900  0.69531900  1
  O  O29  1  0.51710900  0.66362200  0.52889300  1
  O  O30  1  0.50418500  0.00821800  0.87998300  1
  O  O31  1  0.84563200  0.29439000  0.50225800  1
  O  O32  1  0.17275200  0.35184300  0.51546800  1
  O  O33  1  0.88167000  0.67764700  0.85995500  1
  O  O34  1  0.59373200  0.31022700  0.64283200  1
  O  O35  1  0.33374300  0.63115900  0.98575400  1
  O  O36  1  0.94875100  0.60069500  0.23773400  1
  O  O37  1  0.66534500  0.72097400  0.99090000  1
  O  O38  1  0.98185500  0.98368300  0.61579000  1
  O  O39  1  0.93311700  0.19136100  0.44093000  1
  O  O40  1  0.99750000  0.34500800  0.97749600  1
  O  O41  1  0.04143700  0.61756800  0.80742700  1
  O  O42  1  0.38773600  0.04873700  0.33055800  1
  O  O43  1  0.24032000  0.38796800  0.34269000  1
  O  O44  1  0.30374800  0.85385900  0.68969900  1
  O  O45  1  0.54293200  0.73950400  0.82899400  1
  O  O46  1  0.45969800  0.27181400  0.16779100  1
  O  O47  1  0.69832500  0.15676400  0.30553200  1
  O  O48  1  0.76220800  0.59073400  0.66329300  1
  O  O49  1  0.61188700  0.96018000  0.66534300  1
  O  O50  1  0.95770300  0.38493400  0.19109200  1
  O  O51  1  0.00517000  0.65821800  0.02184200  1
  O  O52  1  0.05251000  0.80417400  0.55677300  1
  O  O53  1  0.01053600  0.01533900  0.38184600  1
  O  O54  1  0.33600000  0.27848300  0.01038700  1
  O  O55  1  0.06029400  0.40064300  0.76396200  1
  O  O56  1  0.66750400  0.37172500  0.01421000  1
  O  O57  1  0.38132900  0.68651700  0.35127300  1
  O  O58  1  0.11996400  0.32501700  0.13976900  1
  O  O59  1  0.83744800  0.63769500  0.48029600  1
  O  O60  1  0.16983100  0.72722500  0.49382300  1
  O  O61  1  0.49975700  0.99287000  0.12111900  1
  O  O62  1  0.48257300  0.34402100  0.47505300  1
  O  O63  1  0.55157200  0.60619800  0.31047000  1
  O  O64  1  0.79986800  0.85665900  0.18374500  1
  O  O65  1  0.02798400  0.73375600  0.32550300  1
  O  O66  1  0.26000400  0.62887200  0.14496600  1
  O  O67  1  0.11736500  0.97633400  0.16377800  1
  O  O68  1  0.56556200  0.81276200  0.05295100  1
  O  O69  1  0.56637000  0.42471500  0.25014200  1
