# generated using pymatgen
data_LiCuCSO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.20733500
_cell_length_b   5.16277000
_cell_length_c   8.91677926
_cell_angle_alpha   86.59240336
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCuCSO7
_chemical_formula_sum   'Li2 Cu2 C2 S2 O14'
_cell_volume   285.25117767
_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  0.50162300  0.76775100  0.78795600  1
  Li  Li1  1  0.00162300  0.23224900  0.21204400  1
  Cu  Cu2  1  0.24587000  0.22631800  0.65013900  1
  Cu  Cu3  1  0.74587000  0.77368200  0.34986100  1
  C  C4  1  0.25643500  0.27372500  0.92863300  1
  C  C5  1  0.75643500  0.72627500  0.07136700  1
  S  S6  1  0.74865200  0.27846400  0.57404800  1
  S  S7  1  0.24865200  0.72153600  0.42595200  1
  O  O8  1  0.72868400  0.70220300  0.93369300  1
  O  O9  1  0.26212300  0.05029500  0.86799400  1
  O  O10  1  0.27599700  0.47327100  0.83163700  1
  O  O11  1  0.93407800  0.20828200  0.67393500  1
  O  O12  1  0.55993800  0.17193000  0.66282100  1
  O  O13  1  0.26243200  0.83586900  0.57341700  1
  O  O14  1  0.72631900  0.56699600  0.55173900  1
  O  O15  1  0.22631900  0.43300400  0.44826100  1
  O  O16  1  0.76243200  0.16413100  0.42658300  1
  O  O17  1  0.05993800  0.82807000  0.33717900  1
  O  O18  1  0.43407800  0.79171800  0.32606500  1
  O  O19  1  0.77599700  0.52672900  0.16836300  1
  O  O20  1  0.76212300  0.94970500  0.13200600  1
  O  O21  1  0.22868400  0.29779700  0.06630700  1
