# generated using pymatgen data_Nd2Te3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.43785769 _cell_length_b 12.07679838 _cell_length_c 12.35619939 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2Te3 _chemical_formula_sum 'Nd8 Te12' _cell_volume 662.23189714 _cell_formula_units_Z 4 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 0.25000000 0.49831779 0.69605450 1.0 Nd Nd1 1 0.75000000 0.50168221 0.30394550 1.0 Nd Nd2 1 0.75000000 0.99831779 0.80394550 1.0 Nd Nd3 1 0.25000000 0.00168221 0.19605450 1.0 Nd Nd4 1 0.25000000 0.18755665 0.51616751 1.0 Nd Nd5 1 0.75000000 0.81244335 0.48383249 1.0 Nd Nd6 1 0.75000000 0.68755665 0.98383249 1.0 Nd Nd7 1 0.25000000 0.31244335 0.01616751 1.0 Te Te8 1 0.25000000 0.87642475 0.95731846 1.0 Te Te9 1 0.75000000 0.12357525 0.04268154 1.0 Te Te10 1 0.75000000 0.37642475 0.54268154 1.0 Te Te11 1 0.25000000 0.62357525 0.45731846 1.0 Te Te12 1 0.25000000 0.19728067 0.77442473 1.0 Te Te13 1 0.75000000 0.80271933 0.22557527 1.0 Te Te14 1 0.75000000 0.69728067 0.72557527 1.0 Te Te15 1 0.25000000 0.30271933 0.27442473 1.0 Te Te16 1 0.25000000 0.55691784 0.11854629 1.0 Te Te17 1 0.75000000 0.44308216 0.88145371 1.0 Te Te18 1 0.75000000 0.05691784 0.38145371 1.0 Te Te19 1 0.25000000 0.94308216 0.61854629 1.0