# generated using pymatgen data_Nd5Si9As3Ir19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.95448208 _cell_length_b 12.95448281 _cell_length_c 3.99372866 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000064 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd5Si9As3Ir19 _chemical_formula_sum 'Nd5 Si9 As3 Ir19' _cell_volume 580.42928773 _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 0.80860004 0.50000000 1.0 Nd Nd1 1 0.19139996 0.19139996 0.50000000 1.0 Nd Nd2 1 0.80860004 1.00000000 0.50000000 1.0 Nd Nd3 1 0.33333300 0.66666700 0.00000000 1.0 Nd Nd4 1 0.66666700 0.33333300 0.00000000 1.0 Si Si5 1 0.51812676 0.68835394 0.50000000 1.0 Si Si6 1 0.31164606 0.82977282 0.50000000 1.0 Si Si7 1 0.17022718 0.48187324 0.50000000 1.0 Si Si8 1 0.48187324 0.17022718 0.50000000 1.0 Si Si9 1 0.68835394 0.51812676 0.50000000 1.0 Si Si10 1 0.82977282 0.31164606 0.50000000 1.0 Si Si11 1 0.00000000 0.62842093 0.00000000 1.0 Si Si12 1 0.37157907 0.37157907 0.00000000 1.0 Si Si13 1 0.62842093 1.00000000 0.00000000 1.0 As As14 1 1.00000000 0.18144061 0.00000000 1.0 As As15 1 0.81855939 0.81855939 0.00000000 1.0 As As16 1 0.18144061 0.00000000 0.00000000 1.0 Ir Ir17 1 1.00000000 0.28907569 0.50000000 1.0 Ir Ir18 1 0.71092431 0.71092431 0.50000000 1.0 Ir Ir19 1 0.28907569 0.00000000 0.50000000 1.0 Ir Ir20 1 0.61942831 0.80302243 0.00000000 1.0 Ir Ir21 1 0.19697757 0.81640589 0.00000000 1.0 Ir Ir22 1 0.18359411 0.38057169 0.00000000 1.0 Ir Ir23 1 0.38057169 0.18359411 0.00000000 1.0 Ir Ir24 1 0.80302243 0.61942831 0.00000000 1.0 Ir Ir25 1 0.81640589 0.19697757 0.00000000 1.0 Ir Ir26 1 0.51199065 0.87501873 0.50000000 1.0 Ir Ir27 1 0.12498127 0.63697292 0.50000000 1.0 Ir Ir28 1 0.36302708 0.48800935 0.50000000 1.0 Ir Ir29 1 0.48800935 0.36302708 0.50000000 1.0 Ir Ir30 1 0.87501873 0.51199065 0.50000000 1.0 Ir Ir31 1 0.63697292 0.12498127 0.50000000 1.0 Ir Ir32 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir33 1 1.00000000 0.44714834 0.00000000 1.0 Ir Ir34 1 0.55285166 0.55285166 0.00000000 1.0 Ir Ir35 1 0.44714834 0.00000000 0.00000000 1.0