# generated using pymatgen data_SmEr15(C2Br3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.64650527 _cell_length_b 10.60033400 _cell_length_c 20.19058523 _cell_angle_alpha 90.16861939 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmEr15(C2Br3)4 _chemical_formula_sum 'Sm1 Er15 C8 Br12' _cell_volume 780.44701028 _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 Sm Sm0 1 0.25000000 0.86909342 0.57847002 1.0 Er Er1 1 0.75000000 0.13198268 0.41816779 1.0 Er Er2 1 0.75000000 0.63000599 0.08040294 1.0 Er Er3 1 0.25000000 0.36971049 0.92015551 1.0 Er Er4 1 0.25000000 0.87205455 0.74526849 1.0 Er Er5 1 0.75000000 0.12804893 0.25516627 1.0 Er Er6 1 0.75000000 0.62820679 0.24286540 1.0 Er Er7 1 0.25000000 0.37213530 0.75761064 1.0 Er Er8 1 0.25000000 0.86192408 0.16886573 1.0 Er Er9 1 0.75000000 0.13786454 0.83122802 1.0 Er Er10 1 0.75000000 0.63712721 0.67148047 1.0 Er Er11 1 0.25000000 0.36245407 0.32898077 1.0 Er Er12 1 0.25000000 0.89564763 0.32714937 1.0 Er Er13 1 0.75000000 0.10472419 0.67293872 1.0 Er Er14 1 0.75000000 0.60557810 0.82974640 1.0 Er Er15 1 0.25000000 0.39471130 0.17069522 1.0 C C16 1 0.25000000 0.61920544 0.75262004 1.0 C C17 1 0.75000000 0.37924078 0.24803882 1.0 C C18 1 0.75000000 0.87954644 0.24950615 1.0 C C19 1 0.25000000 0.12171087 0.75059139 1.0 C C20 1 0.25000000 0.62711785 0.15547014 1.0 C C21 1 0.75000000 0.37273552 0.84521733 1.0 C C22 1 0.75000000 0.87182695 0.66001194 1.0 C C23 1 0.25000000 0.12838887 0.34266980 1.0 Br Br24 1 0.25000000 0.60641449 0.55788293 1.0 Br Br25 1 0.75000000 0.38564050 0.44246513 1.0 Br Br26 1 0.75000000 0.88282437 0.05498775 1.0 Br Br27 1 0.25000000 0.11681341 0.94533308 1.0 Br Br28 1 0.25000000 0.63027623 0.95496864 1.0 Br Br29 1 0.75000000 0.36942492 0.04563359 1.0 Br Br30 1 0.75000000 0.87032408 0.44903141 1.0 Br Br31 1 0.25000000 0.13813209 0.54460765 1.0 Br Br32 1 0.25000000 0.63062448 0.35549635 1.0 Br Br33 1 0.75000000 0.36841062 0.64540375 1.0 Br Br34 1 0.75000000 0.86996088 0.85863795 1.0 Br Br35 1 0.25000000 0.13010996 0.14223539 1.0