# generated using pymatgen data_TmTh7(Nb3Si4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.00577257 _cell_length_b 7.24497869 _cell_length_c 13.55796825 _cell_angle_alpha 90.13404592 _cell_angle_beta 89.88622976 _cell_angle_gamma 90.06074551 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmTh7(Nb3Si4)4 _chemical_formula_sum 'Tm1 Th7 Nb12 Si16' _cell_volume 688.15373723 _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 Tm Tm0 1 0.00162515 0.82857570 0.59823415 1.0 Th Th1 1 0.50317076 0.66905162 0.59577746 1.0 Th Th2 1 0.00242399 0.83011225 0.90311595 1.0 Th Th3 1 0.49842820 0.33085352 0.09651683 1.0 Th Th4 1 0.99662713 0.17015035 0.40512471 1.0 Th Th5 1 0.49663450 0.33074416 0.40564727 1.0 Th Th6 1 0.99843301 0.16945030 0.09646429 1.0 Th Th7 1 0.50233310 0.67004938 0.90165063 1.0 Nb Nb8 1 0.66168076 0.17501254 0.62394781 1.0 Nb Nb9 1 0.16182963 0.32473873 0.87384604 1.0 Nb Nb10 1 0.33759095 0.82538733 0.12514535 1.0 Nb Nb11 1 0.83683868 0.67613278 0.37614523 1.0 Nb Nb12 1 0.33653073 0.82542215 0.37563511 1.0 Nb Nb13 1 0.83761194 0.67468587 0.12516451 1.0 Nb Nb14 1 0.66514721 0.17248465 0.87397545 1.0 Nb Nb15 1 0.16346016 0.32491718 0.62417187 1.0 Nb Nb16 1 0.83663974 0.48953287 0.75019233 1.0 Nb Nb17 1 0.33723736 0.00660906 0.74855106 1.0 Nb Nb18 1 0.16332979 0.50932048 0.25063546 1.0 Nb Nb19 1 0.66307523 0.99221393 0.25111839 1.0 Si Si20 1 0.65959174 0.95780052 0.45887546 1.0 Si Si21 1 0.15897304 0.54256958 0.04266288 1.0 Si Si22 1 0.34241870 0.04306411 0.95621256 1.0 Si Si23 1 0.84596472 0.46480752 0.54478924 1.0 Si Si24 1 0.33353203 0.03707641 0.54427816 1.0 Si Si25 1 0.84088505 0.45666822 0.95672165 1.0 Si Si26 1 0.65862576 0.95703746 0.04296567 1.0 Si Si27 1 0.15570832 0.54661594 0.45947613 1.0 Si Si28 1 0.45746843 0.36749351 0.74950770 1.0 Si Si29 1 0.95958632 0.12762305 0.74683494 1.0 Si Si30 1 0.54221301 0.63192393 0.25077922 1.0 Si Si31 1 0.04186500 0.86889030 0.25068469 1.0 Si Si32 1 0.70494479 0.88708478 0.74631721 1.0 Si Si33 1 0.19612274 0.61476452 0.74690396 1.0 Si Si34 1 0.30060109 0.11150106 0.25084581 1.0 Si Si35 1 0.80085123 0.38963523 0.25108380 1.0