# generated using pymatgen data_Nd6Al5Fe9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.16411503 _cell_length_b 8.16412488 _cell_length_c 13.27579803 _cell_angle_alpha 107.90467797 _cell_angle_beta 107.90460799 _cell_angle_gamma 90.00963662 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd6Al5Fe9 _chemical_formula_sum 'Nd12 Al10 Fe18' _cell_volume 796.84343294 _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 Nd Nd0 1 0.10767359 0.10765975 0.21536950 1.0 Nd Nd1 1 0.89237656 0.89240388 0.78471687 1.0 Nd Nd2 1 0.39238175 0.39234957 0.78469608 1.0 Nd Nd3 1 0.60766662 0.60768114 0.21539231 1.0 Nd Nd4 1 0.35784542 0.85787941 0.38430521 1.0 Nd Nd5 1 0.64216981 0.14213020 0.61573530 1.0 Nd Nd6 1 0.02631957 0.52628718 0.38419763 1.0 Nd Nd7 1 0.52639752 0.35784130 0.38430485 1.0 Nd Nd8 1 0.14213415 0.97358932 0.61573787 1.0 Nd Nd9 1 0.97370276 0.47372961 0.61583932 1.0 Nd Nd10 1 0.47361316 0.64217039 0.61573182 1.0 Nd Nd11 1 0.85787897 0.02643082 0.38431086 1.0 Al Al12 1 0.71285941 0.21284981 0.18879545 1.0 Al Al13 1 0.28719667 0.78719666 0.81129039 1.0 Al Al14 1 0.47606907 0.97607949 0.18897015 1.0 Al Al15 1 0.97591869 0.71281293 0.18894516 1.0 Al Al16 1 0.78721727 0.52412327 0.81112275 1.0 Al Al17 1 0.52396198 0.02396264 0.81109530 1.0 Al Al18 1 0.02410636 0.28720796 0.81111286 1.0 Al Al19 1 0.21280648 0.47591378 0.18894745 1.0 Al Al20 1 0.25001722 0.25000326 0.50003293 1.0 Al Al21 1 0.75001435 0.75002742 0.50004941 1.0 Fe Fe22 1 0.23316306 0.73323397 0.11399558 1.0 Fe Fe23 1 0.76680519 0.26672644 0.88594297 1.0 Fe Fe24 1 0.88057148 0.38049538 0.11359131 1.0 Fe Fe25 1 0.38050368 0.23302598 0.11378835 1.0 Fe Fe26 1 0.26686807 0.11940392 0.88614859 1.0 Fe Fe27 1 0.11940831 0.61947731 0.88635375 1.0 Fe Fe28 1 0.61947896 0.76695328 0.88616151 1.0 Fe Fe29 1 0.73309741 0.88058129 0.11378701 1.0 Fe Fe30 1 -0.00001069 0.49998584 -0.00002834 1.0 Fe Fe31 1 0.49998750 -0.00000769 -0.00002600 1.0 Fe Fe32 1 0.06993085 0.20956649 -0.00020599 1.0 Fe Fe33 1 0.93002115 0.79037889 0.00010281 1.0 Fe Fe34 1 0.79032370 0.07000898 -0.00007757 1.0 Fe Fe35 1 0.42990977 0.70970158 -0.00002276 1.0 Fe Fe36 1 0.20962817 0.92995325 -0.00002587 1.0 Fe Fe37 1 0.57003609 0.29025109 -0.00008097 1.0 Fe Fe38 1 0.70963823 0.56995853 -0.00020060 1.0 Fe Fe39 1 0.29031070 0.42997668 0.00009678 1.0