# generated using pymatgen data_ZnS _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.83199387 _cell_length_b 3.83199387 _cell_length_c 38.84817300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999774 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZnS _chemical_formula_sum 'Zn12 S12' _cell_volume 494.02718972 _cell_formula_units_Z 12 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 Zn Zn0 1 0.33333300 0.66666700 0.82156800 1.0 Zn Zn1 1 0.33333300 0.66666700 0.33290200 1.0 Zn Zn2 1 0.00000000 0.00000000 0.25043400 1.0 Zn Zn3 1 0.66666700 0.33333300 0.86825100 1.0 Zn Zn4 1 0.00000000 0.00000000 0.73715000 1.0 Zn Zn5 1 0.66666700 0.33333300 0.16786100 1.0 Zn Zn6 1 0.66666700 0.33333300 0.65687200 1.0 Zn Zn7 1 0.33333300 0.66666700 0.57651900 1.0 Zn Zn8 1 0.66666700 0.33333300 0.41478600 1.0 Zn Zn9 1 0.00000000 0.00000000 0.49594100 1.0 Zn Zn10 1 0.33333300 0.66666700 0.08541000 1.0 Zn Zn11 1 0.00000000 0.00000000 0.00305900 1.0 S S12 1 0.66666700 0.33333300 0.47571100 1.0 S S13 1 0.66666700 0.33333300 0.22937300 1.0 S S14 1 0.33333300 0.66666700 0.63704400 1.0 S S15 1 0.33333300 0.66666700 0.98298300 1.0 S S16 1 0.66666700 0.33333300 0.71735700 1.0 S S17 1 0.66666700 0.33333300 0.92474400 1.0 S S18 1 0.33333300 0.66666700 0.14690300 1.0 S S19 1 0.00000000 0.00000000 0.55660300 1.0 S S20 1 0.33333300 0.66666700 0.39415300 1.0 S S21 1 0.00000000 0.00000000 0.79759500 1.0 S S22 1 0.00000000 0.00000000 0.31192800 1.0 S S23 1 0.00000000 0.00000000 0.06485600 1.0