# generated using pymatgen
data_LiNi9S10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.99834300
_cell_length_b   8.60174300
_cell_length_c   11.63630495
_cell_angle_alpha   64.17932958
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNi9S10
_chemical_formula_sum   'Li2 Ni18 S20'
_cell_volume   540.44733774
_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  0.00000000  0.50000000  0.50000000  1
  Li  Li1  1  0.50000000  0.50000000  0.00000000  1
  Ni  Ni2  1  0.49544000  0.59416400  0.59715900  1
  Ni  Ni3  1  0.00000000  0.00000000  0.50000000  1
  Ni  Ni4  1  0.00730400  0.70055100  0.69407800  1
  Ni  Ni5  1  0.50140800  0.79330300  0.79918100  1
  Ni  Ni6  1  0.50187400  0.09119300  0.59817900  1
  Ni  Ni7  1  0.00187400  0.90880700  0.90182100  1
  Ni  Ni8  1  0.00140800  0.20669700  0.70081900  1
  Ni  Ni9  1  0.50730400  0.29944900  0.80592200  1
  Ni  Ni10  1  0.50000000  0.00000000  0.00000000  1
  Ni  Ni11  1  0.99812600  0.09119300  0.09817900  1
  Ni  Ni12  1  0.99544000  0.40583600  0.90284100  1
  Ni  Ni13  1  0.49859200  0.20669700  0.20081900  1
  Ni  Ni14  1  0.99269600  0.29944900  0.30592200  1
  Ni  Ni15  1  0.00456000  0.59416400  0.09715900  1
  Ni  Ni16  1  0.49269600  0.70055100  0.19407800  1
  Ni  Ni17  1  0.50456000  0.40583600  0.40284100  1
  Ni  Ni18  1  0.99859200  0.79330300  0.29918100  1
  Ni  Ni19  1  0.49812600  0.90880700  0.40182100  1
  S  S20  1  0.16373900  0.76708400  0.48899300  1
  S  S21  1  0.66436900  0.83548500  0.60523100  1
  S  S22  1  0.17577800  0.95440000  0.69379000  1
  S  S23  1  0.34657300  0.33692500  0.60694500  1
  S  S24  1  0.67577800  0.04560000  0.80621000  1
  S  S25  1  0.82897100  0.44261500  0.71053000  1
  S  S26  1  0.16436900  0.16451500  0.89476900  1
  S  S27  1  0.32897100  0.55738500  0.78947000  1
  S  S28  1  0.66373900  0.23291600  0.01100700  1
  S  S29  1  0.15342700  0.33692500  0.10694500  1
  S  S30  1  0.84657300  0.66307500  0.89305500  1
  S  S31  1  0.67102900  0.44261500  0.21053000  1
  S  S32  1  0.33626100  0.76708400  0.98899300  1
  S  S33  1  0.17102900  0.55738500  0.28947000  1
  S  S34  1  0.83563100  0.83548500  0.10523100  1
  S  S35  1  0.65342700  0.66307500  0.39305500  1
  S  S36  1  0.32422200  0.95440000  0.19379000  1
  S  S37  1  0.82422200  0.04560000  0.30621000  1
  S  S38  1  0.33563100  0.16451500  0.39476900  1
  S  S39  1  0.83626100  0.23291600  0.51100700  1
