# generated using pymatgen data_LiAcP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.45181336 _cell_length_b 9.45181236 _cell_length_c 3.90731179 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999484 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiAcP7Ru12 _chemical_formula_sum 'Li1 Ac1 P7 Ru12' _cell_volume 302.30055885 _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 Li Li0 1 0.66666700 0.33333300 0.50000000 1.0 Ac Ac1 1 0.33333300 0.66666700 0.00000000 1.0 P P2 1 0.61230729 0.70753517 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.29246483 0.90477212 0.50000000 1.0 P P5 1 0.09522788 0.38769271 0.50000000 1.0 P P6 1 0.89892478 0.58771433 0.00000000 1.0 P P7 1 0.41228567 0.31120945 0.00000000 1.0 P P8 1 0.68879055 0.10107522 0.00000000 1.0 Ru Ru9 1 0.56387399 0.96000186 0.50000000 1.0 Ru Ru10 1 0.39612987 0.43612601 0.50000000 1.0 Ru Ru11 1 0.90989334 0.11369870 0.50000000 1.0 Ru Ru12 1 0.20380536 0.09010666 0.50000000 1.0 Ru Ru13 1 0.88630130 0.79619464 0.50000000 1.0 Ru Ru14 1 0.72731359 0.87739043 0.00000000 1.0 Ru Ru15 1 0.12260957 0.84992316 0.00000000 1.0 Ru Ru16 1 0.15007684 0.27268641 0.00000000 1.0 Ru Ru17 1 0.43556574 0.08449478 0.00000000 1.0 Ru Ru18 1 0.91550522 0.35107197 0.00000000 1.0 Ru Ru19 1 0.64892803 0.56443426 0.00000000 1.0 Ru Ru20 1 0.03999814 0.60387013 0.50000000 1.0