# generated using pymatgen data_Nd4Si5Tc16P3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.11686756 _cell_length_b 7.25629908 _cell_length_c 15.33565437 _cell_angle_alpha 89.84170374 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd4Si5Tc16P3 _chemical_formula_sum 'Nd4 Si5 Tc16 P3' _cell_volume 458.12366332 _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 Nd Nd0 1 0.00000000 0.58088277 0.11613017 1.0 Nd Nd1 1 0.00000000 0.41613402 0.88378954 1.0 Nd Nd2 1 0.50000000 0.08053508 0.38608832 1.0 Nd Nd3 1 0.50000000 0.91847311 0.61314939 1.0 Si Si4 1 0.50000000 0.68673481 0.97269483 1.0 Si Si5 1 0.00000000 0.29511634 0.27321748 1.0 Si Si6 1 0.00000000 0.70117140 0.72535117 1.0 Si Si7 1 0.50000000 0.79441403 0.22762802 1.0 Si Si8 1 0.50000000 0.19961800 0.77284068 1.0 Tc Tc9 1 0.00000000 0.14001030 0.05374615 1.0 Tc Tc10 1 0.00000000 0.86671922 0.94862313 1.0 Tc Tc11 1 0.50000000 0.63761314 0.44755780 1.0 Tc Tc12 1 0.50000000 0.36122673 0.55181853 1.0 Tc Tc13 1 0.00000000 0.73087020 0.32127438 1.0 Tc Tc14 1 0.00000000 0.26721273 0.67857668 1.0 Tc Tc15 1 0.50000000 0.23437351 0.17811952 1.0 Tc Tc16 1 0.50000000 0.77443403 0.81839010 1.0 Tc Tc17 1 0.00000000 0.42701812 0.41932843 1.0 Tc Tc18 1 0.00000000 0.57122039 0.57966739 1.0 Tc Tc19 1 0.50000000 0.93329576 0.08296146 1.0 Tc Tc20 1 0.50000000 0.06923251 0.92204249 1.0 Tc Tc21 1 0.00000000 0.99195689 0.20697438 1.0 Tc Tc22 1 0.00000000 0.00370352 0.79302584 1.0 Tc Tc23 1 0.50000000 0.49011531 0.29368285 1.0 Tc Tc24 1 0.50000000 0.50738258 0.70667853 1.0 P P25 1 0.00000000 0.80747926 0.47125297 1.0 P P26 1 0.00000000 0.19217838 0.52866126 1.0 P P27 1 0.50000000 0.32087487 0.02672752 1.0