# generated using pymatgen data_SmNi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.96578458 _cell_length_b 4.96580020 _cell_length_c 8.59821903 _cell_angle_alpha 73.24079563 _cell_angle_beta 73.24069917 _cell_angle_gamma 60.02766322 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmNi3 _chemical_formula_sum 'Sm3 Ni9' _cell_volume 173.18663177 _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 Sm Sm0 1 0.13891974 0.13891974 0.58386359 1.0 Sm Sm1 1 0.86108026 0.86108026 0.41613641 1.0 Sm Sm2 1 0.00000000 0.00000000 -0.00000000 1.0 Ni Ni3 1 0.08085543 0.58144370 0.75780250 1.0 Ni Ni4 1 0.58134620 0.58134620 0.75767392 1.0 Ni Ni5 1 0.58144370 0.08085543 0.75780150 1.0 Ni Ni6 1 0.91914457 0.41855630 0.24219650 1.0 Ni Ni7 1 0.41865380 0.41865380 0.24232508 1.0 Ni Ni8 1 0.41855630 0.91914457 0.24219750 1.0 Ni Ni9 1 0.33321506 0.33321606 0.00076213 1.0 Ni Ni10 1 0.66678494 0.66678394 0.99923787 1.0 Ni Ni11 1 0.50000000 0.50000000 0.50000000 1.0