# generated using pymatgen data_Li(SiNi)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.44204711 _cell_length_b 8.44204711 _cell_length_c 7.58627000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999302 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li(SiNi)6 _chemical_formula_sum 'Li3 Si18 Ni18' _cell_volume 468.22489440 _cell_formula_units_Z 3 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 0.33333300 0.66666700 0.00000000 1.0 Li Li1 1 0.66666700 0.33333300 0.00000000 1.0 Li Li2 1 0.00000000 0.00000000 0.50000000 1.0 Si Si3 1 0.00000000 0.00000000 0.15619200 1.0 Si Si4 1 0.33333300 0.66666700 0.65655100 1.0 Si Si5 1 0.66666700 0.33333300 0.65655100 1.0 Si Si6 1 0.66666700 0.33333300 0.34344900 1.0 Si Si7 1 0.33333300 0.66666700 0.34344900 1.0 Si Si8 1 0.66979300 0.00000000 0.50000000 1.0 Si Si9 1 0.66979300 0.66979300 0.50000000 1.0 Si Si10 1 0.00000000 0.33020700 0.50000000 1.0 Si Si11 1 0.00000000 0.66979300 0.50000000 1.0 Si Si12 1 0.33020700 0.33020700 0.50000000 1.0 Si Si13 1 0.33020700 0.00000000 0.50000000 1.0 Si Si14 1 0.66283300 0.00000000 0.00000000 1.0 Si Si15 1 0.66283300 0.66283300 0.00000000 1.0 Si Si16 1 0.00000000 0.33716700 0.00000000 1.0 Si Si17 1 0.00000000 0.66283300 0.00000000 1.0 Si Si18 1 0.33716700 0.33716700 0.00000000 1.0 Si Si19 1 0.00000000 0.00000000 0.84380800 1.0 Si Si20 1 0.33716700 0.00000000 0.00000000 1.0 Ni Ni21 1 0.00000000 0.50000000 0.74458000 1.0 Ni Ni22 1 0.50000000 0.00000000 0.74458000 1.0 Ni Ni23 1 0.00000000 0.50000000 0.25542000 1.0 Ni Ni24 1 0.50000000 0.50000000 0.25542000 1.0 Ni Ni25 1 0.50000000 0.00000000 0.25542000 1.0 Ni Ni26 1 0.16679000 0.83321000 0.75232400 1.0 Ni Ni27 1 0.16679000 0.33358100 0.75232400 1.0 Ni Ni28 1 0.66641900 0.83321000 0.75232400 1.0 Ni Ni29 1 0.33358100 0.16679000 0.75232400 1.0 Ni Ni30 1 0.83321000 0.66641900 0.24767600 1.0 Ni Ni31 1 0.83321000 0.16679000 0.75232400 1.0 Ni Ni32 1 0.83321000 0.66641900 0.75232400 1.0 Ni Ni33 1 0.16679000 0.83321000 0.24767600 1.0 Ni Ni34 1 0.66641900 0.83321000 0.24767600 1.0 Ni Ni35 1 0.33358100 0.16679000 0.24767600 1.0 Ni Ni36 1 0.83321000 0.16679000 0.24767600 1.0 Ni Ni37 1 0.16679000 0.33358100 0.24767600 1.0 Ni Ni38 1 0.50000000 0.50000000 0.74458000 1.0