# generated using pymatgen data_Li3Y5(Ni4P3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.05469308 _cell_length_b 12.05469196 _cell_length_c 3.76380567 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000039 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li3Y5(Ni4P3)4 _chemical_formula_sum 'Li3 Y5 Ni16 P12' _cell_volume 473.66369316 _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 0.56519150 0.56519150 0.00000000 1.0 Li Li1 1 0.43480850 0.00000000 0.00000000 1.0 Li Li2 1 1.00000000 0.43480850 0.00000000 1.0 Y Y3 1 0.18901063 0.18901063 0.50000000 1.0 Y Y4 1 0.81098937 0.00000000 0.50000000 1.0 Y Y5 1 1.00000000 0.81098937 0.50000000 1.0 Y Y6 1 0.33333300 0.66666700 0.00000000 1.0 Y Y7 1 0.66666700 0.33333300 0.00000000 1.0 Ni Ni8 1 0.71919172 0.71919172 0.50000000 1.0 Ni Ni9 1 0.28080828 1.00000000 0.50000000 1.0 Ni Ni10 1 0.00000000 0.28080828 0.50000000 1.0 Ni Ni11 1 0.18435354 0.38034390 0.00000000 1.0 Ni Ni12 1 0.61965610 0.80401164 0.00000000 1.0 Ni Ni13 1 0.19598836 0.81564646 0.00000000 1.0 Ni Ni14 1 0.80401164 0.61965610 0.00000000 1.0 Ni Ni15 1 0.81564646 0.19598836 0.00000000 1.0 Ni Ni16 1 0.38034390 0.18435354 0.00000000 1.0 Ni Ni17 1 0.36276438 0.48486050 0.50000000 1.0 Ni Ni18 1 0.51513950 0.87790489 0.50000000 1.0 Ni Ni19 1 0.12209511 0.63723562 0.50000000 1.0 Ni Ni20 1 0.87790489 0.51513950 0.50000000 1.0 Ni Ni21 1 0.63723562 0.12209511 0.50000000 1.0 Ni Ni22 1 0.48486050 0.36276438 0.50000000 1.0 Ni Ni23 1 0.00000000 0.00000000 0.00000000 1.0 P P24 1 0.82107302 0.82107302 0.00000000 1.0 P P25 1 0.17892698 1.00000000 0.00000000 1.0 P P26 1 0.00000000 0.17892698 0.00000000 1.0 P P27 1 0.16985395 0.47623020 0.50000000 1.0 P P28 1 0.52376980 0.69362275 0.50000000 1.0 P P29 1 0.30637725 0.83014605 0.50000000 1.0 P P30 1 0.69362275 0.52376980 0.50000000 1.0 P P31 1 0.83014605 0.30637725 0.50000000 1.0 P P32 1 0.47623020 0.16985395 0.50000000 1.0 P P33 1 0.36619421 0.36619421 0.00000000 1.0 P P34 1 0.63380579 1.00000000 0.00000000 1.0 P P35 1 0.00000000 0.63380579 0.00000000 1.0