# generated using pymatgen data_La9Pr3(Si7Br3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.14310908 _cell_length_b 11.88182600 _cell_length_c 16.88139806 _cell_angle_alpha 89.87150805 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural La9Pr3(Si7Br3)2 _chemical_formula_sum 'La9 Pr3 Si14 Br6' _cell_volume 831.03033028 _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 La La0 1 0.50000000 0.34184444 0.50221354 1.0 La La1 1 0.00000000 0.65736524 0.99978812 1.0 La La2 1 0.00000000 0.64359003 0.74452248 1.0 La La3 1 0.50000000 0.35626913 0.24420834 1.0 La La4 1 0.00000000 0.64198810 0.25625863 1.0 La La5 1 0.50000000 0.06781942 0.87918724 1.0 La La6 1 0.00000000 0.93462526 0.61927523 1.0 La La7 1 0.50000000 0.06613432 0.11818512 1.0 La La8 1 0.00000000 0.93222280 0.38053540 1.0 Pr Pr9 1 0.50000000 0.36026960 0.75751276 1.0 Pr Pr10 1 0.50000000 0.35833614 0.99939169 1.0 Pr Pr11 1 0.00000000 0.64088664 0.50103738 1.0 Si Si12 1 0.00000000 0.15493827 0.99876291 1.0 Si Si13 1 0.50000000 0.84537293 0.50023622 1.0 Si Si14 1 0.50000000 0.56373773 0.87723048 1.0 Si Si15 1 0.00000000 0.43566466 0.62437357 1.0 Si Si16 1 0.50000000 0.56219925 0.12238126 1.0 Si Si17 1 0.00000000 0.43619900 0.37857388 1.0 Si Si18 1 0.00000000 0.25705209 0.87494516 1.0 Si Si19 1 0.50000000 0.74421550 0.62406585 1.0 Si Si20 1 0.00000000 0.25551828 0.12315308 1.0 Si Si21 1 0.50000000 0.74284289 0.37687700 1.0 Si Si22 1 0.00000000 0.45860659 0.87654281 1.0 Si Si23 1 0.50000000 0.54173393 0.62486022 1.0 Si Si24 1 0.50000000 0.54119621 0.37666982 1.0 Si Si25 1 0.00000000 0.45707916 0.12393343 1.0 Br Br26 1 0.50000000 0.11154391 0.69095396 1.0 Br Br27 1 0.00000000 0.89344551 0.80774235 1.0 Br Br28 1 0.00000000 0.13712164 0.49886147 1.0 Br Br29 1 0.50000000 0.86237787 0.99903930 1.0 Br Br30 1 0.50000000 0.10625687 0.30732929 1.0 Br Br31 1 0.00000000 0.89154761 0.19134702 1.0