# generated using pymatgen data_Y3AlNiS7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.53899835 _cell_length_b 9.53899835 _cell_length_c 6.16810100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000243 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y3AlNiS7 _chemical_formula_sum 'Y6 Al2 Ni2 S14' _cell_volume 486.05749569 _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 Y Y0 1 0.77522600 0.15079200 0.22241700 1.0 Y Y1 1 0.37556600 0.22477400 0.22241700 1.0 Y Y2 1 0.84920800 0.62443400 0.22241700 1.0 Y Y3 1 0.22477400 0.84920800 0.72241700 1.0 Y Y4 1 0.62443400 0.77522600 0.72241700 1.0 Y Y5 1 0.15079200 0.37556600 0.72241700 1.0 Al Al6 1 0.66666700 0.33333300 0.65348000 1.0 Al Al7 1 0.33333300 0.66666700 0.15348000 1.0 Ni Ni8 1 0.00000000 0.00000000 0.05105200 1.0 Ni Ni9 1 0.00000000 0.00000000 0.55105200 1.0 S S10 1 0.86619100 0.09757700 0.81793900 1.0 S S11 1 0.23138600 0.13380900 0.81793900 1.0 S S12 1 0.90242300 0.76861400 0.81793900 1.0 S S13 1 0.13380900 0.90242300 0.31793900 1.0 S S14 1 0.76861400 0.86619100 0.31793900 1.0 S S15 1 0.09757700 0.23138600 0.31793900 1.0 S S16 1 0.91066700 0.42919400 0.49603200 1.0 S S17 1 0.51852700 0.08933300 0.49603200 1.0 S S18 1 0.57080600 0.48147300 0.49603200 1.0 S S19 1 0.08933300 0.57080600 0.99603200 1.0 S S20 1 0.48147300 0.91066700 0.99603200 1.0 S S21 1 0.42919400 0.51852700 0.99603200 1.0 S S22 1 0.66666700 0.33333300 0.01427300 1.0 S S23 1 0.33333300 0.66666700 0.51427300 1.0