# generated using pymatgen data_Tm3Zr(V3Si4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.71107125 _cell_length_b 6.71048997 _cell_length_c 12.43892521 _cell_angle_alpha 90.07448484 _cell_angle_beta 90.13222609 _cell_angle_gamma 89.98492793 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm3Zr(V3Si4)2 _chemical_formula_sum 'Tm6 Zr2 V12 Si16' _cell_volume 560.17974244 _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 Tm Tm0 1 0.00072058 0.66264955 0.03016385 1.0 Tm Tm1 1 0.00072813 0.33645610 0.53073908 1.0 Tm Tm2 1 0.66336061 0.99995315 0.96995136 1.0 Tm Tm3 1 0.16340976 0.49981470 0.77903900 1.0 Tm Tm4 1 0.83778174 0.49989721 0.28195805 1.0 Tm Tm5 1 0.50037026 0.16324488 0.22000795 1.0 Zr Zr6 1 0.50592670 0.84115967 0.71842306 1.0 Zr Zr7 1 0.34101568 0.99388161 0.46898826 1.0 V V8 1 0.34073124 0.51143537 0.37747474 1.0 V V9 1 0.84053703 0.99294489 0.37655759 1.0 V V10 1 0.01020673 0.15868994 0.12602314 1.0 V V11 1 0.99013733 0.84259463 0.62542926 1.0 V V12 1 0.65612703 0.49148222 0.87385132 1.0 V V13 1 0.50443148 0.33998763 0.62441354 1.0 V V14 1 0.49067594 0.65996287 0.12477454 1.0 V V15 1 0.15931537 0.00646182 0.87230879 1.0 V V16 1 0.66493295 0.67198118 0.50067929 1.0 V V17 1 0.82876764 0.16473119 0.74870810 1.0 V V18 1 0.17075686 0.83135260 0.25087991 1.0 V V19 1 0.33173287 0.33084758 0.99862313 1.0 Si Si20 1 0.04172210 0.71325653 0.43710818 1.0 Si Si21 1 0.96011503 0.28852414 0.93538158 1.0 Si Si22 1 0.70760283 0.04131913 0.56421965 1.0 Si Si23 1 0.21092120 0.45974898 0.18673547 1.0 Si Si24 1 0.78602630 0.54110153 0.68556208 1.0 Si Si25 1 0.45886860 0.20766484 0.81335062 1.0 Si Si26 1 0.54074758 0.79028716 0.31461579 1.0 Si Si27 1 0.28968402 0.96004537 0.06338103 1.0 Si Si28 1 0.87265558 0.79682918 0.81577047 1.0 Si Si29 1 0.12789630 0.19959885 0.31877342 1.0 Si Si30 1 0.80029400 0.87531683 0.18514383 1.0 Si Si31 1 0.29846045 0.63017007 0.56890723 1.0 Si Si32 1 0.70108121 0.37588436 0.06558400 1.0 Si Si33 1 0.62123292 0.29630235 0.43444347 1.0 Si Si34 1 0.37471336 0.70287507 0.93131135 1.0 Si Si35 1 0.20630959 0.12154882 0.68071886 1.0