# generated using pymatgen data_Zr10Ga4P2S _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.08562193 _cell_length_b 8.08943316 _cell_length_c 5.67786505 _cell_angle_alpha 90.21929176 _cell_angle_beta 89.56120662 _cell_angle_gamma 119.98443232 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr10Ga4P2S _chemical_formula_sum 'Zr10 Ga4 P2 S1' _cell_volume 321.66409764 _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 0.99515720 0.73786121 0.24273054 1.0 Zr Zr1 1 0.25729599 0.26213879 0.24273054 1.0 Zr Zr2 1 0.74779398 1.00000000 0.24005954 1.0 Zr Zr3 1 0.99934979 0.25891381 0.76143906 1.0 Zr Zr4 1 0.74043598 0.74108619 0.76143906 1.0 Zr Zr5 1 0.25424760 0.00000000 0.76509248 1.0 Zr Zr6 1 0.33273198 0.65969692 0.49790920 1.0 Zr Zr7 1 0.67303607 0.34030308 0.49790920 1.0 Zr Zr8 1 0.67001544 0.33826778 0.00029319 1.0 Zr Zr9 1 0.33174666 0.66173222 0.00029319 1.0 Ga Ga10 1 0.39295899 0.00000000 0.25396806 1.0 Ga Ga11 1 0.00242081 0.61273842 0.74991292 1.0 Ga Ga12 1 0.38968239 0.38726158 0.74991292 1.0 Ga Ga13 1 0.60490230 0.00000000 0.74932847 1.0 P P14 1 0.99883965 0.39015970 0.24178564 1.0 P P15 1 0.60868095 0.60984030 0.24178564 1.0 S S16 1 0.00070422 1.00000000 0.50340932 1.0