# generated using pymatgen data_LiNb(NiP)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.60216274 _cell_length_b 6.06535710 _cell_length_c 6.87024741 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiNb(NiP)2 _chemical_formula_sum 'Li2 Nb2 Ni4 P4' _cell_volume 150.10393633 _cell_formula_units_Z 2 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 0.25000000 0.52753484 0.67988689 1.0 Li Li1 1 0.25000000 0.02753484 0.82011311 1.0 Nb Nb2 1 0.75000000 0.96948478 0.17484098 1.0 Nb Nb3 1 0.75000000 0.46948478 0.32515902 1.0 Ni Ni4 1 0.75000000 0.35768976 0.93423218 1.0 Ni Ni5 1 0.25000000 0.13937600 0.44783159 1.0 Ni Ni6 1 0.75000000 0.85768976 0.56576782 1.0 Ni Ni7 1 0.25000000 0.63937600 0.05216841 1.0 P P8 1 0.25000000 0.76996582 0.38014318 1.0 P P9 1 0.25000000 0.26996582 0.11985682 1.0 P P10 1 0.75000000 0.23594781 0.62342081 1.0 P P11 1 0.75000000 0.73594781 0.87657919 1.0