# generated using pymatgen
data_Li2MnCSO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95251109
_cell_length_b   9.38687783
_cell_length_c   13.01032870
_cell_angle_alpha   90.03119691
_cell_angle_beta   90.02513250
_cell_angle_gamma   81.94138122
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2MnCSO7
_chemical_formula_sum   'Li8 Mn4 C4 S4 O28'
_cell_volume   598.85943404
_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  0.20852800  0.16455900  0.25743300  1
  Li  Li1  1  0.20850400  0.16451600  0.75741400  1
  Li  Li2  1  0.20855400  0.16448900  0.49258600  1
  Li  Li3  1  0.20839700  0.16453600  0.99263800  1
  Li  Li4  1  0.79152000  0.83546800  0.00744600  1
  Li  Li5  1  0.79153300  0.83555000  0.50742500  1
  Li  Li6  1  0.79146300  0.83551000  0.24265600  1
  Li  Li7  1  0.79159800  0.83538800  0.74263000  1
  Mn  Mn8  1  0.74812200  0.36232200  0.87472800  1
  Mn  Mn9  1  0.25145600  0.63775800  0.62500900  1
  Mn  Mn10  1  0.74916100  0.36230500  0.37494900  1
  Mn  Mn11  1  0.25084600  0.63767100  0.12506700  1
  C  C12  1  0.72423400  0.07692900  0.37494100  1
  C  C13  1  0.72413400  0.07670200  0.87491800  1
  C  C14  1  0.27593100  0.92313500  0.12511500  1
  C  C15  1  0.27590600  0.92315200  0.62511100  1
  S  S16  1  0.77325100  0.40092900  0.12492200  1
  S  S17  1  0.77338500  0.40095000  0.62491600  1
  S  S18  1  0.22673100  0.59916200  0.37504000  1
  S  S19  1  0.22650000  0.59899700  0.87498900  1
  O  O20  1  0.30699600  0.05650300  0.12505600  1
  O  O21  1  0.30699200  0.05656900  0.62507200  1
  O  O22  1  0.69308700  0.94361400  0.37504900  1
  O  O23  1  0.69313400  0.94331900  0.87504400  1
  O  O24  1  0.96486100  0.11859700  0.37490500  1
  O  O25  1  0.96460800  0.11845000  0.87488400  1
  O  O26  1  0.03534000  0.88146100  0.12511400  1
  O  O27  1  0.03539700  0.88148000  0.62510800  1
  O  O28  1  0.51170100  0.17927000  0.37491300  1
  O  O29  1  0.51137100  0.17894800  0.87486600  1
  O  O30  1  0.48850400  0.82084800  0.12513500  1
  O  O31  1  0.48854200  0.82092400  0.62509800  1
  O  O32  1  0.13476100  0.45588700  0.37494800  1
  O  O33  1  0.13427500  0.45582600  0.87492500  1
  O  O34  1  0.86553400  0.54411800  0.12506800  1
  O  O35  1  0.86555200  0.54409800  0.62505100  1
  O  O36  1  0.46805600  0.42353900  0.12498200  1
  O  O37  1  0.46820600  0.42348400  0.62494500  1
  O  O38  1  0.53192000  0.57670600  0.37509900  1
  O  O39  1  0.53177000  0.57638500  0.87509100  1
  O  O40  1  0.87414500  0.31518700  0.03276300  1
  O  O41  1  0.87439300  0.31519700  0.53273800  1
  O  O42  1  0.87450900  0.31501000  0.21693700  1
  O  O43  1  0.87465900  0.31489800  0.71689300  1
  O  O44  1  0.12536400  0.68501600  0.28304700  1
  O  O45  1  0.12561100  0.68490000  0.78299300  1
  O  O46  1  0.12546000  0.68488300  0.46719700  1
  O  O47  1  0.12549500  0.68485700  0.96714600  1
