# generated using pymatgen data_Hf2SiNi3P2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.60565553 _cell_length_b 9.98506013 _cell_length_c 12.22694831 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf2SiNi3P2 _chemical_formula_sum 'Hf8 Si4 Ni12 P8' _cell_volume 440.20299651 _cell_formula_units_Z 4 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 Hf Hf0 1 0.25000000 0.34092583 0.99561037 1.0 Hf Hf1 1 0.25000000 0.15907417 0.49561037 1.0 Hf Hf2 1 0.75000000 0.65907417 0.00438963 1.0 Hf Hf3 1 0.75000000 0.84092583 0.50438963 1.0 Hf Hf4 1 0.25000000 0.42346494 0.71166769 1.0 Hf Hf5 1 0.25000000 0.07653506 0.21166769 1.0 Hf Hf6 1 0.75000000 0.57653506 0.28833231 1.0 Hf Hf7 1 0.75000000 0.92346494 0.78833231 1.0 Si Si8 1 0.25000000 0.10152632 0.89782925 1.0 Si Si9 1 0.25000000 0.39847368 0.39782925 1.0 Si Si10 1 0.75000000 0.89847368 0.10217075 1.0 Si Si11 1 0.75000000 0.60152632 0.60217075 1.0 Ni Ni12 1 0.25000000 0.90263966 0.98319474 1.0 Ni Ni13 1 0.25000000 0.59736034 0.48319474 1.0 Ni Ni14 1 0.75000000 0.09736034 0.01680526 1.0 Ni Ni15 1 0.75000000 0.40263966 0.51680526 1.0 Ni Ni16 1 0.25000000 0.13640587 0.71605353 1.0 Ni Ni17 1 0.25000000 0.36359413 0.21605353 1.0 Ni Ni18 1 0.75000000 0.86359413 0.28394647 1.0 Ni Ni19 1 0.75000000 0.63640587 0.78394647 1.0 Ni Ni20 1 0.25000000 0.77121141 0.16664163 1.0 Ni Ni21 1 0.25000000 0.72878859 0.66664163 1.0 Ni Ni22 1 0.75000000 0.22878859 0.83335837 1.0 Ni Ni23 1 0.75000000 0.27121141 0.33335837 1.0 P P24 1 0.25000000 0.73774757 0.85638522 1.0 P P25 1 0.25000000 0.76225243 0.35638522 1.0 P P26 1 0.75000000 0.26225243 0.14361478 1.0 P P27 1 0.75000000 0.23774757 0.64361478 1.0 P P28 1 0.25000000 0.55304225 0.12767666 1.0 P P29 1 0.25000000 0.94695775 0.62767666 1.0 P P30 1 0.75000000 0.44695775 0.87232334 1.0 P P31 1 0.75000000 0.05304225 0.37232334 1.0