# generated using pymatgen
data_Li2CrCSO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.44567800
_cell_length_b   10.26051418
_cell_length_c   8.98859677
_cell_angle_alpha   87.56221380
_cell_angle_beta   90.00003626
_cell_angle_gamma   89.99983690
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CrCSO7
_chemical_formula_sum   'Li8 Cr4 C4 S4 O28'
_cell_volume   593.93157357
_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  0.97463500  0.10846100  0.18072600  1
  Li  Li1  1  0.97459500  0.60842100  0.18067800  1
  Li  Li2  1  0.52527800  0.10847400  0.18075400  1
  Li  Li3  1  0.52534200  0.60839300  0.18071000  1
  Li  Li4  1  0.47462300  0.39156600  0.81928900  1
  Li  Li5  1  0.47462000  0.89158400  0.81932000  1
  Li  Li6  1  0.02530400  0.39157800  0.81925400  1
  Li  Li7  1  0.02530400  0.89159300  0.81927500  1
  Cr  Cr8  1  0.75000600  0.88129300  0.36048400  1
  Cr  Cr9  1  0.25004500  0.61887500  0.63944900  1
  Cr  Cr10  1  0.75011600  0.38119000  0.36072200  1
  Cr  Cr11  1  0.25005300  0.11878400  0.63954700  1
  C  C12  1  0.74999800  0.36129100  0.06212100  1
  C  C13  1  0.74998100  0.86134700  0.06205800  1
  C  C14  1  0.24999200  0.13869800  0.93795300  1
  C  C15  1  0.24999000  0.63864800  0.93787100  1
  S  S16  1  0.25007900  0.35336400  0.42392400  1
  S  S17  1  0.24995700  0.85345600  0.42385700  1
  S  S18  1  0.74998500  0.14657000  0.57617700  1
  S  S19  1  0.75004300  0.64657800  0.57602400  1
  O  O20  1  0.24997500  0.12556300  0.08030800  1
  O  O21  1  0.24998300  0.62545900  0.08022800  1
  O  O22  1  0.74997900  0.37444800  0.91975600  1
  O  O23  1  0.74998500  0.87450400  0.91969000  1
  O  O24  1  0.75001700  0.46625800  0.14406900  1
  O  O25  1  0.74997200  0.96632600  0.14398900  1
  O  O26  1  0.25001200  0.03370200  0.85604000  1
  O  O27  1  0.25000200  0.53370600  0.85588500  1
  O  O28  1  0.74999700  0.24903500  0.13388000  1
  O  O29  1  0.74998400  0.74910600  0.13383000  1
  O  O30  1  0.24999000  0.25092800  0.86615000  1
  O  O31  1  0.24998500  0.75091100  0.86612600  1
  O  O32  1  0.74996800  0.10712300  0.41899700  1
  O  O33  1  0.74999500  0.60714200  0.41883200  1
  O  O34  1  0.25000700  0.39287200  0.58108800  1
  O  O35  1  0.24998000  0.89286100  0.58106000  1
  O  O36  1  0.25003300  0.20677500  0.42445700  1
  O  O37  1  0.25000500  0.70687000  0.42431200  1
  O  O38  1  0.74997900  0.29316600  0.57565500  1
  O  O39  1  0.75000000  0.79315600  0.57554300  1
  O  O40  1  0.06662100  0.40563400  0.34111800  1
  O  O41  1  0.06647500  0.90576600  0.34111600  1
  O  O42  1  0.43357200  0.40562200  0.34114700  1
  O  O43  1  0.43341300  0.90578600  0.34112100  1
  O  O44  1  0.56652300  0.09428700  0.65896500  1
  O  O45  1  0.56657400  0.59425900  0.65877700  1
  O  O46  1  0.93346900  0.09428800  0.65892800  1
  O  O47  1  0.93356100  0.59428600  0.65874000  1
