| |
| data_La3Sb3Au4 |
| _symmetry_space_group_name_H-M 'P 1' |
| _cell_length_a 8.58910221 |
| _cell_length_b 8.82444625 |
| _cell_length_c 8.83755195 |
| _cell_angle_alpha 107.08431724 |
| _cell_angle_beta 109.65959137 |
| _cell_angle_gamma 110.45018649 |
| _symmetry_Int_Tables_number 1 |
| _chemical_formula_structural La3Sb3Au4 |
| _chemical_formula_sum 'La6 Sb6 Au8' |
| _cell_volume 522.88573320 |
| _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 |
| La La0 1 0.41048181 0.87719136 0.91188401 1 |
| La La1 1 0.39793065 0.88163102 0.43712708 1 |
| La La2 1 0.81221336 0.79357576 0.61383855 1 |
| La La3 1 0.00482363 0.40506795 0.06221360 1 |
| La La4 1 0.54998827 0.33221710 0.69968206 1 |
| La La5 1 0.86938775 0.90918100 0.23203476 1 |
| Sb Sb6 1 0.52751088 0.57184851 0.37538597 1 |
| Sb Sb7 1 0.22770509 0.93151492 0.50599253 1 |
| Sb Sb8 1 0.05375490 0.74361694 0.98576653 1 |
| Sb Sb9 1 0.99303675 0.32941744 0.39456275 1 |
| Sb Sb10 1 0.61822903 0.40025100 0.15517798 1 |
| Sb Sb11 1 0.14665513 0.19859535 0.84244800 1 |
| Au Au12 1 0.40687010 0.58324760 0.11080007 1 |
| Au Au13 1 0.90270358 0.24741524 0.62215871 1 |
| Au Au14 1 0.28940377 0.13616167 0.26943061 1 |
| Au Au15 1 0.87268704 0.58632052 0.08840773 1 |
| Au Au16 1 0.12750542 0.57009280 0.58174324 1 |
| Au Au17 1 0.38556442 0.45880029 0.78618735 1 |
| Au Au18 1 0.64603579 0.02623047 0.37691206 1 |
| Au Au19 1 0.75751257 0.01762296 0.94824654 1 |
|
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