# generated using pymatgen data_Zr10Sb6S _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.51333529 _cell_length_b 8.51333712 _cell_length_c 5.82168682 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000450 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr10Sb6S _chemical_formula_sum 'Zr10 Sb6 S1' _cell_volume 365.40881480 _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 Zr Zr0 1 0.00000000 0.74987081 0.24173243 1.0 Zr Zr1 1 0.25012919 0.25012919 0.24173243 1.0 Zr Zr2 1 0.74987081 1.00000000 0.24173243 1.0 Zr Zr3 1 1.00000000 0.25012919 0.75826757 1.0 Zr Zr4 1 0.74987081 0.74987081 0.75826757 1.0 Zr Zr5 1 0.25012919 0.00000000 0.75826757 1.0 Zr Zr6 1 0.33333300 0.66666700 0.50000000 1.0 Zr Zr7 1 0.66666700 0.33333300 0.50000000 1.0 Zr Zr8 1 0.66666700 0.33333300 0.00000000 1.0 Zr Zr9 1 0.33333300 0.66666700 0.00000000 1.0 Sb Sb10 1 1.00000000 0.39337117 0.24724015 1.0 Sb Sb11 1 0.60662883 0.60662883 0.24724015 1.0 Sb Sb12 1 0.39337117 0.00000000 0.24724015 1.0 Sb Sb13 1 0.00000000 0.60662883 0.75275985 1.0 Sb Sb14 1 0.39337117 0.39337117 0.75275985 1.0 Sb Sb15 1 0.60662883 1.00000000 0.75275985 1.0 S S16 1 0.00000000 0.00000000 0.50000000 1.0