# generated using pymatgen
data_Mg2NiW3S8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.45991403
_cell_length_b   7.46074626
_cell_length_c   7.46029939
_cell_angle_alpha   54.97662068
_cell_angle_beta   54.95885474
_cell_angle_gamma   54.97031836
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2NiW3S8
_chemical_formula_sum   'Mg2 Ni1 W3 S8'
_cell_volume   259.22589425
_cell_formula_units_Z   1
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
  Mg  Mg0  1  0.87359600  0.87363800  0.87368200  1.0
  Mg  Mg1  1  0.12639800  0.12636000  0.12633200  1.0
  Ni  Ni2  1  0.49999500  0.50002000  0.49998500  1.0
  W  W3  1  0.50022600  0.50023200  0.99956400  1.0
  W  W4  1  0.99963200  0.50015300  0.50023400  1.0
  W  W5  1  0.50016200  0.99961600  0.50024600  1.0
  S  S6  1  0.74373100  0.74386500  0.74382100  1.0
  S  S7  1  0.26905100  0.26926100  0.71008500  1.0
  S  S8  1  0.26899900  0.71010000  0.26916000  1.0
  S  S9  1  0.70989500  0.26933600  0.26931800  1.0
  S  S10  1  0.73097600  0.28983000  0.73080200  1.0
  S  S11  1  0.29002400  0.73064400  0.73065500  1.0
  S  S12  1  0.25637100  0.25621500  0.25624900  1.0
  S  S13  1  0.73094900  0.73072500  0.28986900  1.0