# generated using pymatgen data_PmNi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.79339656 _cell_length_b 5.79313308 _cell_length_c 4.19356486 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99205438 _symmetry_Int_Tables_number 1 _chemical_formula_structural PmNi3 _chemical_formula_sum 'Pm2 Ni6' _cell_volume 121.89770379 _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 Pm Pm0 1 0.33330972 0.66659088 0.74999900 1.0 Pm Pm1 1 0.66665440 0.33315494 0.25000100 1.0 Ni Ni2 1 0.13844099 0.27695301 0.25000100 1.0 Ni Ni3 1 0.72304011 0.86161484 0.25000100 1.0 Ni Ni4 1 0.13848593 0.86163507 0.25000100 1.0 Ni Ni5 1 0.86146539 0.72301002 0.74999900 1.0 Ni Ni6 1 0.27694605 0.13857138 0.74999900 1.0 Ni Ni7 1 0.86165542 0.13846486 0.74999900 1.0