# generated using pymatgen data_Tm4Sc6Ga7Si _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.15907277 _cell_length_b 7.46321210 _cell_length_c 14.29782222 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.21117080 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm4Sc6Ga7Si _chemical_formula_sum 'Tm8 Sc12 Ga14 Si2' _cell_volume 763.92285702 _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 0.01278026 0.18050633 0.09521328 1.0 Tm Tm1 1 0.98721974 0.81949367 0.90478672 1.0 Tm Tm2 1 0.48725654 0.68072823 0.90513678 1.0 Tm Tm3 1 0.98721974 0.81949367 0.59521328 1.0 Tm Tm4 1 0.51274346 0.31927177 0.09486322 1.0 Tm Tm5 1 0.01278026 0.18050633 0.40478672 1.0 Tm Tm6 1 0.51274346 0.31927177 0.40513678 1.0 Tm Tm7 1 0.48725654 0.68072823 0.59486322 1.0 Sc Sc8 1 0.16089945 0.50459200 0.75000000 1.0 Sc Sc9 1 0.83910055 0.49540800 0.25000000 1.0 Sc Sc10 1 0.33584507 0.00530303 0.25000000 1.0 Sc Sc11 1 0.66415493 0.99469697 0.75000000 1.0 Sc Sc12 1 0.33118401 0.17406284 0.62327368 1.0 Sc Sc13 1 0.66881599 0.82593716 0.37672632 1.0 Sc Sc14 1 0.17134256 0.67205665 0.37628837 1.0 Sc Sc15 1 0.66881599 0.82593716 0.12327368 1.0 Sc Sc16 1 0.82865744 0.32794335 0.62371163 1.0 Sc Sc17 1 0.33118401 0.17406284 0.87672632 1.0 Sc Sc18 1 0.82865744 0.32794335 0.87628837 1.0 Sc Sc19 1 0.17134256 0.67205665 0.12371163 1.0 Ga Ga20 1 0.03292760 0.11614692 0.75000000 1.0 Ga Ga21 1 0.96707240 0.88385308 0.25000000 1.0 Ga Ga22 1 0.46768281 0.60920648 0.25000000 1.0 Ga Ga23 1 0.53231719 0.39079352 0.75000000 1.0 Ga Ga24 1 0.28184303 0.87142285 0.75000000 1.0 Ga Ga25 1 0.71815697 0.12857715 0.25000000 1.0 Ga Ga26 1 0.16070890 0.46586783 0.54023729 1.0 Ga Ga27 1 0.83929110 0.53413217 0.45976271 1.0 Ga Ga28 1 0.33713150 0.96629021 0.45966015 1.0 Ga Ga29 1 0.83929110 0.53413217 0.04023729 1.0 Ga Ga30 1 0.66286850 0.03370979 0.54033985 1.0 Ga Ga31 1 0.16070890 0.46586783 0.95976271 1.0 Ga Ga32 1 0.66286850 0.03370979 0.95966015 1.0 Ga Ga33 1 0.33713150 0.96629021 0.04033985 1.0 Si Si34 1 0.21828166 0.37337684 0.25000000 1.0 Si Si35 1 0.78171834 0.62662316 0.75000000 1.0