# generated using pymatgen
data_LiCr(SO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.31777000
_cell_length_b   8.34177257
_cell_length_c   8.87790699
_cell_angle_alpha   62.14691753
_cell_angle_beta   62.37246231
_cell_angle_gamma   60.16266302
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCr(SO4)2
_chemical_formula_sum   'Li3 Cr3 S6 O24'
_cell_volume   450.44328051
_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  0.35758500  0.35064900  0.93626600  1
  Li  Li1  1  0.17759800  0.76153900  0.62927200  1
  Li  Li2  1  0.76058100  0.43163100  0.62866300  1
  Cr  Cr3  1  0.16080400  0.15641800  0.53639400  1
  Cr  Cr4  1  0.64231600  0.64461200  0.06896200  1
  Cr  Cr5  1  0.84665500  0.85397000  0.45051800  1
  S  S6  1  0.04264800  0.45956100  0.74971600  1
  S  S7  1  0.45608600  0.75590700  0.74753100  1
  S  S8  1  0.75349200  0.04150000  0.74494800  1
  S  S9  1  0.25237200  0.95895200  0.24587500  1
  S  S10  1  0.54184800  0.25510500  0.24595400  1
  S  S11  1  0.95897000  0.54456000  0.24572500  1
  O  O12  1  0.10748600  0.51096400  0.08422600  1
  O  O13  1  0.29874500  0.10820600  0.08539600  1
  O  O14  1  0.00375000  0.33807900  0.69567500  1
  O  O15  1  0.51538300  0.29982800  0.07972300  1
  O  O16  1  0.02355800  0.65822900  0.60626400  1
  O  O17  1  0.23604300  0.37600100  0.76282100  1
  O  O18  1  0.37012800  0.63453600  0.75513900  1
  O  O19  1  0.33467600  0.96495100  0.69749300  1
  O  O20  1  0.64056600  0.23904700  0.75544700  1
  O  O21  1  0.04626300  0.98081800  0.29642600  1
  O  O22  1  0.27901500  0.96245600  0.40512400  1
  O  O23  1  0.35073500  0.28634500  0.39505700  1
  O  O24  1  0.65508600  0.71378400  0.60679500  1
  O  O25  1  0.71801600  0.02534400  0.60298000  1
  O  O26  1  0.96831200  0.00092300  0.69759600  1
  O  O27  1  0.38151700  0.75739700  0.23585500  1
  O  O28  1  0.67411800  0.04806700  0.29795000  1
  O  O29  1  0.62645500  0.38351400  0.23567300  1
  O  O30  1  0.75664000  0.62505300  0.23629600  1
  O  O31  1  0.96524500  0.35538400  0.40393600  1
  O  O32  1  0.48326200  0.70179600  0.91979600  1
  O  O33  1  0.97872100  0.67845400  0.29775000  1
  O  O34  1  0.70195200  0.89528500  0.91776800  1
  O  O35  1  0.88787100  0.48743400  0.91819000  1
