# generated using pymatgen
data_Li(Mo3S4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53171600
_cell_length_b   9.05160914
_cell_length_c   9.44187187
_cell_angle_alpha   89.82814408
_cell_angle_beta   89.57265669
_cell_angle_gamma   86.36190818
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li(Mo3S4)2
_chemical_formula_sum   'Li2 Mo12 S16'
_cell_volume   557.08520855
_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  0.09994700  0.30326700  0.26317400  1
  Li  Li1  1  0.90005300  0.69673300  0.73682600  1
  Mo  Mo2  1  0.21616700  0.27065400  0.67816500  1
  Mo  Mo3  1  0.21718100  0.77247200  0.17692000  1
  Mo  Mo4  1  0.40449600  0.86780300  0.41709900  1
  Mo  Mo5  1  0.45321400  0.56650600  0.34333200  1
  Mo  Mo6  1  0.40483600  0.36527800  0.91501500  1
  Mo  Mo7  1  0.45005700  0.06085900  0.84424800  1
  Mo  Mo8  1  0.54678600  0.43349400  0.65666800  1
  Mo  Mo9  1  0.59550400  0.13219700  0.58290100  1
  Mo  Mo10  1  0.54994300  0.93914100  0.15575200  1
  Mo  Mo11  1  0.59516400  0.63472200  0.08498500  1
  Mo  Mo12  1  0.78383300  0.72934600  0.32183500  1
  Mo  Mo13  1  0.78281900  0.22752800  0.82308000  1
  S  S14  1  0.13383500  0.69368600  0.42052600  1
  S  S15  1  0.13139900  0.19281300  0.92246700  1
  S  S16  1  0.27306900  0.01015000  0.62389200  1
  S  S17  1  0.21508900  0.03142100  0.25034800  1
  S  S18  1  0.26933000  0.50921000  0.12387100  1
  S  S19  1  0.21507700  0.52947500  0.75071100  1
  S  S20  1  0.38647000  0.31818400  0.44957000  1
  S  S21  1  0.38954700  0.81940400  0.95270400  1
  S  S22  1  0.61353000  0.68181600  0.55043000  1
  S  S23  1  0.61045300  0.18059600  0.04729600  1
  S  S24  1  0.78491100  0.96857900  0.74965200  1
  S  S25  1  0.72693100  0.98985000  0.37610800  1
  S  S26  1  0.78492300  0.47052500  0.24928900  1
  S  S27  1  0.73067000  0.49079000  0.87612900  1
  S  S28  1  0.86616500  0.30631400  0.57947400  1
  S  S29  1  0.86860100  0.80718700  0.07753300  1
