# generated using pymatgen
data_LiCoHSO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45958000
_cell_length_b   7.43205600
_cell_length_c   9.84356784
_cell_angle_alpha   69.81340990
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCoHSO5
_chemical_formula_sum   'Li4 Co4 H4 S4 O20'
_cell_volume   374.87733084
_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  0.44001700  0.68548600  0.08560000  1
  Li  Li1  1  0.94001700  0.81451400  0.91440000  1
  Li  Li2  1  0.55998300  0.31451400  0.91440000  1
  Li  Li3  1  0.05998300  0.18548600  0.08560000  1
  Co  Co4  1  0.76859400  0.88002500  0.55061300  1
  Co  Co5  1  0.26859400  0.61997500  0.44938700  1
  Co  Co6  1  0.23140600  0.11997500  0.44938700  1
  Co  Co7  1  0.73140600  0.38002500  0.55061300  1
  H  H8  1  0.49119300  0.39835200  0.33485300  1
  H  H9  1  0.99119300  0.10164800  0.66514700  1
  H  H10  1  0.50880700  0.60164800  0.66514700  1
  H  H11  1  0.00880700  0.89835200  0.33485300  1
  S  S12  1  0.05872400  0.51059700  0.78522300  1
  S  S13  1  0.55872400  0.98940300  0.21477700  1
  S  S14  1  0.94127600  0.48940300  0.21477700  1
  S  S15  1  0.44127600  0.01059700  0.78522300  1
  O  O16  1  0.92780500  0.13326700  0.56571000  1
  O  O17  1  0.42780500  0.36673300  0.43429000  1
  O  O18  1  0.07219500  0.86673300  0.43429000  1
  O  O19  1  0.57219500  0.63326700  0.56571000  1
  O  O20  1  0.44773100  0.96029600  0.64894100  1
  O  O21  1  0.94773100  0.53970400  0.35105900  1
  O  O22  1  0.55226900  0.03970400  0.35105900  1
  O  O23  1  0.05226900  0.46029600  0.64894100  1
  O  O24  1  0.55718400  0.20281900  0.75448300  1
  O  O25  1  0.05718400  0.29718100  0.24551700  1
  O  O26  1  0.44281600  0.79718100  0.24551700  1
  O  O27  1  0.94281600  0.70281900  0.75448300  1
  O  O28  1  0.68421900  0.48436200  0.16904900  1
  O  O29  1  0.18421900  0.01563800  0.83095100  1
  O  O30  1  0.31578100  0.51563800  0.83095100  1
  O  O31  1  0.81578100  0.98436200  0.16904900  1
  O  O32  1  0.41833500  0.13442900  0.09827500  1
  O  O33  1  0.91833500  0.36557100  0.90172500  1
  O  O34  1  0.58166500  0.86557100  0.90172500  1
  O  O35  1  0.08166500  0.63442900  0.09827500  1
