# generated using pymatgen
data_Li4Zn(PS4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.24751500
_cell_length_b   10.27820416
_cell_length_c   10.28135402
_cell_angle_alpha   77.30619264
_cell_angle_beta   65.77770271
_cell_angle_gamma   75.16856066
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Zn(PS4)2
_chemical_formula_sum   'Li12 Zn3 P6 S24'
_cell_volume   946.53714702
_cell_formula_units_Z   3
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  0.59702400  0.23857300  0.31527500  1
  Li  Li1  1  0.42304900  0.75459400  0.66575200  1
  Li  Li2  1  0.24052600  0.25013400  0.99727000  1
  Li  Li3  1  0.91233400  0.25469000  0.68320100  1
  Li  Li4  1  0.83161300  0.49908500  0.33398900  1
  Li  Li5  1  0.50305600  0.49763800  0.99513500  1
  Li  Li6  1  0.34841500  0.99087000  0.32095300  1
  Li  Li7  1  0.99414800  0.00683300  0.01061500  1
  Li  Li8  1  0.16626500  0.51033300  0.66795400  1
  Li  Li9  1  0.54287800  0.37499600  0.65615000  1
  Li  Li10  1  0.20834300  0.36380300  0.33225500  1
  Li  Li11  1  0.04883200  0.88528700  0.67774900  1
  Zn  Zn12  1  0.08422600  0.75268900  0.33235100  1
  Zn  Zn13  1  0.74048200  0.74982600  0.01172000  1
  Zn  Zn14  1  0.65996700  0.00022500  0.66804100  1
  P  P15  1  0.46138400  0.62250600  0.33223000  1
  P  P16  1  0.29672800  0.13158900  0.65960300  1
  P  P17  1  0.11948900  0.63021700  0.00550700  1
  P  P18  1  0.95753900  0.12238800  0.34378000  1
  P  P19  1  0.61371800  0.12311100  0.99658900  1
  P  P20  1  0.79799700  0.62150000  0.66355600  1
  S  S21  1  0.36077800  0.16846200  0.43937000  1
  S  S22  1  0.19030500  0.68025300  0.78468700  1
  S  S23  1  0.01199500  0.17214700  0.13052200  1
  S  S24  1  0.85580900  0.68110500  0.44479800  1
  S  S25  1  0.51852700  0.67289500  0.11204000  1
  S  S26  1  0.68696500  0.16978700  0.76979000  1
  S  S27  1  0.46483100  0.78140900  0.41448700  1
  S  S28  1  0.30067700  0.29707700  0.73894200  1
  S  S29  1  0.13328100  0.79370800  0.08316300  1
  S  S30  1  0.96231300  0.28497300  0.42814000  1
  S  S31  1  0.63920600  0.28308700  0.06272700  1
  S  S32  1  0.79576800  0.79391400  0.75086500  1
  S  S33  1  0.59144600  0.45091600  0.39021000  1
  S  S34  1  0.42445900  0.96466200  0.73205500  1
  S  S35  1  0.25361300  0.46068200  0.06142600  1
  S  S36  1  0.09624300  0.95186900  0.40689300  1
  S  S37  1  0.75716300  0.95838400  0.05258400  1
  S  S38  1  0.92892300  0.46708900  0.73243600  1
  S  S39  1  0.59273100  0.57909600  0.73830000  1
  S  S40  1  0.41455500  0.07564100  0.07064700  1
  S  S41  1  0.25113700  0.57490500  0.40596100  1
  S  S42  1  0.09125000  0.08405900  0.75079100  1
  S  S43  1  0.75528800  0.06880400  0.41939100  1
  S  S44  1  0.91639200  0.57919200  0.07677000  1
