# generated using pymatgen
data_Li2H12C3SN6O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.86940430
_cell_length_b   9.86940430
_cell_length_c   8.11463286
_cell_angle_alpha   70.77175018
_cell_angle_beta   70.77175018
_cell_angle_gamma   56.98574861
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2H12C3SN6O7
_chemical_formula_sum   'Li4 H24 C6 S2 N12 O14'
_cell_volume   614.49231623
_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  0.24328300  0.61928800  0.66168200  1
  Li  Li1  1  0.38071200  0.75671700  0.83831800  1
  Li  Li2  1  0.75671700  0.38071200  0.33831800  1
  Li  Li3  1  0.61928800  0.24328300  0.16168200  1
  H  H4  1  0.75976300  0.64456300  0.59587900  1
  H  H5  1  0.35543700  0.24023700  0.90412100  1
  H  H6  1  0.24023700  0.35543700  0.40412100  1
  H  H7  1  0.64456300  0.75976300  0.09587900  1
  H  H8  1  0.88717300  0.73608800  0.49871400  1
  H  H9  1  0.26391200  0.11282700  0.00128600  1
  H  H10  1  0.11282700  0.26391200  0.50128600  1
  H  H11  1  0.73608800  0.88717300  0.99871400  1
  H  H12  1  0.76842700  0.49479800  0.88546900  1
  H  H13  1  0.50520200  0.23157300  0.61453100  1
  H  H14  1  0.23157300  0.50520200  0.11453100  1
  H  H15  1  0.49479800  0.76842700  0.38546900  1
  H  H16  1  0.92536300  0.44315400  0.98584600  1
  H  H17  1  0.55684600  0.07463700  0.51415400  1
  H  H18  1  0.07463700  0.55684600  0.01415400  1
  H  H19  1  0.44315400  0.92536300  0.48584600  1
  H  H20  1  0.13511800  0.07648500  0.79919100  1
  H  H21  1  0.92351500  0.86488200  0.70080900  1
  H  H22  1  0.86488200  0.92351500  0.20080900  1
  H  H23  1  0.07648500  0.13511800  0.29919100  1
  H  H24  1  0.92225500  0.18738800  0.79695900  1
  H  H25  1  0.81261200  0.07774500  0.70304100  1
  H  H26  1  0.07774500  0.81261200  0.20304100  1
  H  H27  1  0.18738800  0.92225500  0.29695900  1
  C  C28  1  0.92788200  0.58529200  0.74059100  1
  C  C29  1  0.41470800  0.07211800  0.75940900  1
  C  C30  1  0.07211800  0.41470800  0.25940900  1
  C  C31  1  0.58529200  0.92788200  0.24059100  1
  C  C32  1  0.04923200  0.95076800  0.75000000  1
  C  C33  1  0.95076800  0.04923200  0.25000000  1
  S  S34  1  0.58609100  0.41390900  0.75000000  1
  S  S35  1  0.41390900  0.58609100  0.25000000  1
  N  N36  1  0.84798200  0.66595200  0.60217700  1
  N  N37  1  0.33404800  0.15201800  0.89782300  1
  N  N38  1  0.15201800  0.33404800  0.39782300  1
  N  N39  1  0.66595200  0.84798200  0.10217700  1
  N  N40  1  0.87935200  0.48541000  0.87282700  1
  N  N41  1  0.51459000  0.12064800  0.62717300  1
  N  N42  1  0.12064800  0.51459000  0.12717300  1
  N  N43  1  0.48541000  0.87935200  0.37282700  1
  N  N44  1  0.03663300  0.08937300  0.76806300  1
  N  N45  1  0.91062700  0.96336700  0.73193700  1
  N  N46  1  0.96336700  0.91062700  0.23193700  1
  N  N47  1  0.08937300  0.03663300  0.26806300  1
  O  O48  1  0.69008900  0.33173500  0.59431700  1
  O  O49  1  0.66826500  0.30991100  0.90568300  1
  O  O50  1  0.30991100  0.66826500  0.40568300  1
  O  O51  1  0.33173500  0.69008900  0.09431700  1
  O  O52  1  0.41932800  0.43046600  0.78743100  1
  O  O53  1  0.56953400  0.58067200  0.71256900  1
  O  O54  1  0.58067200  0.56953400  0.21256900  1
  O  O55  1  0.43046600  0.41932800  0.28743100  1
  O  O56  1  0.04381400  0.60282800  0.74841500  1
  O  O57  1  0.39717200  0.95618600  0.75158500  1
  O  O58  1  0.95618600  0.39717200  0.25158500  1
  O  O59  1  0.60282800  0.04381400  0.24841500  1
  O  O60  1  0.18409100  0.81590900  0.75000000  1
  O  O61  1  0.81590900  0.18409100  0.25000000  1
