# generated using pymatgen data_ScNbNi12P7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.91810903 _cell_length_b 8.91810910 _cell_length_c 3.53133224 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999610 _symmetry_Int_Tables_number 1 _chemical_formula_structural ScNbNi12P7 _chemical_formula_sum 'Sc1 Nb1 Ni12 P7' _cell_volume 243.22868174 _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 Sc Sc0 1 0.66666700 0.33333300 0.50000000 1.0 Nb Nb1 1 0.33333300 0.66666700 0.00000000 1.0 Ni Ni2 1 0.38466539 0.43453007 0.50000000 1.0 Ni Ni3 1 0.04986569 0.61533461 0.50000000 1.0 Ni Ni4 1 0.21973647 0.09036676 0.50000000 1.0 Ni Ni5 1 0.87063030 0.78026353 0.50000000 1.0 Ni Ni6 1 0.90963324 0.12936970 0.50000000 1.0 Ni Ni7 1 0.72220572 0.87951426 0.00000000 1.0 Ni Ni8 1 0.12048574 0.84269046 0.00000000 1.0 Ni Ni9 1 0.15730954 0.27779428 0.00000000 1.0 Ni Ni10 1 0.94009035 0.37535277 0.00000000 1.0 Ni Ni11 1 0.62464723 0.56473858 0.00000000 1.0 Ni Ni12 1 0.43526142 0.05990965 0.00000000 1.0 Ni Ni13 1 0.56546993 0.95013431 0.50000000 1.0 P P14 1 0.00000000 0.00000000 0.00000000 1.0 P P15 1 0.41199808 0.29169749 0.00000000 1.0 P P16 1 0.58423818 0.70651714 0.50000000 1.0 P P17 1 0.29348286 0.87772003 0.50000000 1.0 P P18 1 0.12227997 0.41576182 0.50000000 1.0 P P19 1 0.70830251 0.12030060 0.00000000 1.0 P P20 1 0.87969940 0.58800192 0.00000000 1.0