# generated using pymatgen data_Nb4Si7Ni4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.29046102 _cell_length_b 9.29046102 _cell_length_c 9.29046102 _cell_angle_alpha 94.19155895 _cell_angle_beta 94.19155895 _cell_angle_gamma 148.62933784 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb4Si7Ni4 _chemical_formula_sum 'Nb8 Si14 Ni8' _cell_volume 401.89399168 _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 Nb Nb0 1 0.13454100 0.13454100 0.26908300 1.0 Nb Nb1 1 0.86545900 0.86545900 0.73091700 1.0 Nb Nb2 1 0.86545900 0.13454100 0.00000000 1.0 Nb Nb3 1 0.13454100 0.86545900 0.00000000 1.0 Nb Nb4 1 0.50000000 0.30856100 0.80856100 1.0 Nb Nb5 1 0.50000000 0.69143900 0.19143900 1.0 Nb Nb6 1 0.69143900 0.50000000 0.19143900 1.0 Nb Nb7 1 0.30856100 0.50000000 0.80856100 1.0 Si Si8 1 0.50000000 0.09298400 0.59298400 1.0 Si Si9 1 0.50000000 0.90701600 0.40701600 1.0 Si Si10 1 0.90701600 0.50000000 0.40701600 1.0 Si Si11 1 0.09298400 0.50000000 0.59298400 1.0 Si Si12 1 0.75050900 0.75050900 0.00000000 1.0 Si Si13 1 0.24949100 0.24949100 0.00000000 1.0 Si Si14 1 0.29229800 0.29229800 0.58459600 1.0 Si Si15 1 0.70770200 0.70770200 0.41540400 1.0 Si Si16 1 0.70770200 0.29229800 0.00000000 1.0 Si Si17 1 0.29229800 0.70770200 0.00000000 1.0 Si Si18 1 0.00000000 0.29188200 0.29188200 1.0 Si Si19 1 0.00000000 0.70811800 0.70811800 1.0 Si Si20 1 0.70811800 0.00000000 0.70811800 1.0 Si Si21 1 0.29188200 0.00000000 0.29188200 1.0 Ni Ni22 1 0.39810000 0.89810000 0.79620000 1.0 Ni Ni23 1 0.10190000 0.60190000 0.20380000 1.0 Ni Ni24 1 0.10190000 0.89810000 0.50000000 1.0 Ni Ni25 1 0.39810000 0.60190000 0.50000000 1.0 Ni Ni26 1 0.60190000 0.39810000 0.50000000 1.0 Ni Ni27 1 0.89810000 0.10190000 0.50000000 1.0 Ni Ni28 1 0.89810000 0.39810000 0.79620000 1.0 Ni Ni29 1 0.60190000 0.10190000 0.20380000 1.0