| |
| data_Sm13Sb5 |
| _symmetry_space_group_name_H-M 'P 1' |
| _cell_length_a 6.80621781 |
| _cell_length_b 9.65438700 |
| _cell_length_c 9.62494179 |
| _cell_angle_alpha 119.83514567 |
| _cell_angle_beta 90.21423504 |
| _cell_angle_gamma 90.05871197 |
| _symmetry_Int_Tables_number 1 |
| _chemical_formula_structural Sm13Sb5 |
| _chemical_formula_sum 'Sm13 Sb5' |
| _cell_volume 548.62159733 |
| _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 0.12887937 0.01894271 0.11784280 1 |
| Sm Sm1 1 0.62123162 0.35404593 0.73699439 1 |
| Sm Sm2 1 0.13804886 0.46650478 0.74465704 1 |
| Sm Sm3 1 0.63453418 0.32110718 0.34894168 1 |
| Sm Sm4 1 0.13007703 0.87088406 0.43917996 1 |
| Sm Sm5 1 0.61609727 0.91826290 0.98347270 1 |
| Sm Sm6 1 0.34168911 0.68068516 0.63772953 1 |
| Sm Sm7 1 0.62429792 0.91481197 0.43892345 1 |
| Sm Sm8 1 0.34758416 0.38215074 0.07018691 1 |
| Sm Sm9 1 0.83992618 0.89424855 0.65484589 1 |
| Sm Sm10 1 0.85224611 0.22167739 0.98473632 1 |
| Sm Sm11 1 0.33687595 0.20281404 0.41917053 1 |
| Sb Sb12 1 0.36559480 0.04450762 0.85197973 1 |
| Sm Sm13 1 0.88546294 0.57655203 0.20932481 1 |
| Sb Sb14 1 0.35962027 0.71117806 0.05758237 1 |
| Sb Sb15 1 0.10880844 0.16304988 0.65579832 1 |
| Sb Sb16 1 0.83620465 0.58398974 0.60923088 1 |
| Sb Sb17 1 0.83282107 0.67458725 0.03940257 1 |
|
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