# generated using pymatgen data_Li17Sn4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 13.90427763 _cell_length_b 13.90427763 _cell_length_c 13.90427763 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li17Sn4 _chemical_formula_sum 'Li85 Sn20' _cell_volume 1900.77317710 _cell_formula_units_Z 5 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 0.17381800 0.17381800 0.82618200 1.0 Li Li1 1 0.48807800 0.19245000 0.83139300 1.0 Li Li2 1 0.82618200 0.82618200 0.17381800 1.0 Li Li3 1 0.07876300 0.42123700 0.42123700 1.0 Li Li4 1 0.24272200 0.93086000 0.24272200 1.0 Li Li5 1 0.91781300 0.69406200 0.69406200 1.0 Li Li6 1 0.17553800 0.47338700 0.17553800 1.0 Li Li7 1 0.58369700 0.93086000 0.24272200 1.0 Li Li8 1 0.42273500 0.42273500 0.73179400 1.0 Li Li9 1 0.73129500 0.07668400 0.73129500 1.0 Li Li10 1 0.98440600 0.98440600 0.32999700 1.0 Li Li11 1 0.50157000 0.83281000 0.83281000 1.0 Li Li12 1 0.70119000 0.32999700 0.98440600 1.0 Li Li13 1 0.42273500 0.73179400 0.42273500 1.0 Li Li14 1 0.24272200 0.58369700 0.93086000 1.0 Li Li15 1 0.07876300 0.07876300 0.42123700 1.0 Li Li16 1 0.46072700 0.07668400 0.73129500 1.0 Li Li17 1 0.73129500 0.46072700 0.07668400 1.0 Li Li18 1 0.07668400 0.46072700 0.73129500 1.0 Li Li19 1 0.94676000 0.15971900 0.94676000 1.0 Li Li20 1 0.83281000 0.50157000 0.83281000 1.0 Li Li21 1 0.07876300 0.42123700 0.07876300 1.0 Li Li22 1 0.07668400 0.73129500 0.73129500 1.0 Li Li23 1 0.17381800 0.82618200 0.82618200 1.0 Li Li24 1 0.58369700 0.24272200 0.93086000 1.0 Li Li25 1 0.42273500 0.42273500 0.42273500 1.0 Li Li26 1 0.48807800 0.83139300 0.48807800 1.0 Li Li27 1 0.56802300 0.56802300 0.56802300 1.0 Li Li28 1 0.24272200 0.24272200 0.58369700 1.0 Li Li29 1 0.48807800 0.48807800 0.83139300 1.0 Li Li30 1 0.19245000 0.48807800 0.83139300 1.0 Li Li31 1 0.17553800 0.17553800 0.47338700 1.0 Li Li32 1 0.29593200 0.56802300 0.56802300 1.0 Li Li33 1 0.98440600 0.70119000 0.98440600 1.0 Li Li34 1 0.94676000 0.94676000 0.94676000 1.0 Li Li35 1 0.73179400 0.42273500 0.42273500 1.0 Li Li36 1 0.42123700 0.42123700 0.07876300 1.0 Li Li37 1 0.58369700 0.24272200 0.24272200 1.0 Li Li38 1 0.17381800 0.82618200 0.17381800 1.0 Li Li39 1 0.82618200 0.17381800 0.82618200 1.0 Li Li40 1 0.47338700 0.17553800 0.17553800 1.0 Li Li41 1 0.69406200 0.69406200 0.91781300 1.0 Li Li42 1 0.70119000 0.98440600 0.32999700 1.0 Li Li43 1 0.19245000 0.48807800 0.48807800 1.0 Li Li44 1 0.83281000 0.83281000 0.83281000 1.0 Li Li45 1 0.83139300 0.48807800 0.19245000 1.0 Li Li46 1 0.98440600 0.32999700 0.98440600 1.0 Li Li47 1 0.93086000 0.58369700 0.24272200 1.0 Li Li48 1 0.73129500 0.73129500 0.07668400 1.0 Li Li49 1 0.69406200 0.91781300 0.69406200 1.0 Li Li50 1 0.46072700 0.73129500 0.07668400 1.0 Li Li51 1 0.15971900 0.94676000 0.94676000 1.0 Li Li52 1 0.69406200 0.69406200 0.69406200 1.0 Li Li53 1 0.83281000 0.83281000 0.50157000 1.0 Li Li54 1 0.48807800 0.19245000 0.48807800 1.0 Li Li55 1 0.24272200 0.93086000 0.58369700 1.0 Li Li56 1 0.98440600 0.32999700 0.70119000 1.0 Li Li57 1 0.93086000 0.24272200 0.58369700 1.0 Li Li58 1 0.98440600 0.70119000 0.32999700 1.0 Li Li59 1 0.07668400 0.73129500 0.46072700 1.0 Li Li60 1 0.98440600 0.98440600 0.70119000 1.0 Li Li61 1 0.46072700 0.73129500 0.73129500 1.0 Li Li62 1 0.32999700 0.98440600 0.98440600 1.0 Li Li63 1 0.83139300 0.19245000 0.48807800 1.0 Li Li64 1 0.73129500 0.46072700 0.73129500 1.0 Li Li65 1 0.82618200 0.17381800 0.17381800 1.0 Li Li66 1 0.17553800 0.17553800 0.17553800 1.0 Li Li67 1 0.48807800 0.48807800 0.19245000 1.0 Li Li68 1 0.56802300 0.29593200 0.56802300 1.0 Li Li69 1 0.32999700 0.98440600 0.70119000 1.0 Li Li70 1 0.70119000 0.98440600 0.98440600 1.0 Li Li71 1 0.42123700 0.07876300 0.42123700 1.0 Li Li72 1 0.24272200 0.24272200 0.93086000 1.0 Li Li73 1 0.19245000 0.83139300 0.48807800 1.0 Li Li74 1 0.94676000 0.94676000 0.15971900 1.0 Li Li75 1 0.25000000 0.25000000 0.25000000 1.0 Li Li76 1 0.73129500 0.73129500 0.46072700 1.0 Li Li77 1 0.93086000 0.24272200 0.24272200 1.0 Li Li78 1 0.73129500 0.07668400 0.46072700 1.0 Li Li79 1 0.42123700 0.07876300 0.07876300 1.0 Li Li80 1 0.56802300 0.56802300 0.29593200 1.0 Li Li81 1 0.32999700 0.70119000 0.98440600 1.0 Li Li82 1 0.24272200 0.58369700 0.24272200 1.0 Li Li83 1 0.83139300 0.48807800 0.48807800 1.0 Li Li84 1 0.48807800 0.83139300 0.19245000 1.0 Sn Sn85 1 0.73035800 0.08988100 0.08988100 1.0 Sn Sn86 1 0.92918000 0.92918000 0.57082000 1.0 Sn Sn87 1 0.08988100 0.73035800 0.08988100 1.0 Sn Sn88 1 0.33365700 0.33365700 0.99902800 1.0 Sn Sn89 1 0.67977400 0.32022600 0.32022600 1.0 Sn Sn90 1 0.32022600 0.67977400 0.32022600 1.0 Sn Sn91 1 0.92918000 0.57082000 0.57082000 1.0 Sn Sn92 1 0.57082000 0.92918000 0.57082000 1.0 Sn Sn93 1 0.67977400 0.32022600 0.67977400 1.0 Sn Sn94 1 0.57082000 0.57082000 0.92918000 1.0 Sn Sn95 1 0.33365700 0.99902800 0.33365700 1.0 Sn Sn96 1 0.99902800 0.33365700 0.33365700 1.0 Sn Sn97 1 0.08988100 0.08988100 0.73035800 1.0 Sn Sn98 1 0.92918000 0.57082000 0.92918000 1.0 Sn Sn99 1 0.57082000 0.92918000 0.92918000 1.0 Sn Sn100 1 0.08988100 0.08988100 0.08988100 1.0 Sn Sn101 1 0.33365700 0.33365700 0.33365700 1.0 Sn Sn102 1 0.32022600 0.67977400 0.67977400 1.0 Sn Sn103 1 0.67977400 0.67977400 0.32022600 1.0 Sn Sn104 1 0.32022600 0.32022600 0.67977400 1.0