# generated using pymatgen data_Y2Ta3Ge4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.97549990 _cell_length_b 7.15196682 _cell_length_c 13.47005768 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00050786 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y2Ta3Ge4 _chemical_formula_sum 'Y8 Ta12 Ge16' _cell_volume 672.00156332 _cell_formula_units_Z 4 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 Y Y0 1 0.49557450 0.32662132 0.09507646 1.0 Y Y1 1 0.99556425 0.17336591 0.40491715 1.0 Y Y2 1 0.50442675 0.67339456 0.59505401 1.0 Y Y3 1 0.00442819 0.82662997 0.90494864 1.0 Y Y4 1 0.50442675 0.67339456 0.90494599 1.0 Y Y5 1 0.00442819 0.82662997 0.59505136 1.0 Y Y6 1 0.49557450 0.32662132 0.40492354 1.0 Y Y7 1 0.99556425 0.17336591 0.09508285 1.0 Ta Ta8 1 0.66472950 0.01492448 0.75000000 1.0 Ta Ta9 1 0.16473344 0.48510906 0.75000000 1.0 Ta Ta10 1 0.33526472 0.98506767 0.25000000 1.0 Ta Ta11 1 0.84091842 0.32880467 0.62685861 1.0 Ta Ta12 1 0.34092749 0.17121693 0.87314490 1.0 Ta Ta13 1 0.15908973 0.67118948 0.12689256 1.0 Ta Ta14 1 0.65906684 0.82877964 0.37311214 1.0 Ta Ta15 1 0.15908973 0.67118948 0.37310744 1.0 Ta Ta16 1 0.65906684 0.82877964 0.12688786 1.0 Ta Ta17 1 0.84091842 0.32880467 0.87314139 1.0 Ta Ta18 1 0.34092749 0.17121693 0.62685510 1.0 Ta Ta19 1 0.83527260 0.51489204 0.25000000 1.0 Ge Ge20 1 0.80651443 0.63772207 0.75000000 1.0 Ge Ge21 1 0.30651105 0.86231512 0.75000000 1.0 Ge Ge22 1 0.19349299 0.36226977 0.25000000 1.0 Ge Ge23 1 0.69346862 0.13768620 0.25000000 1.0 Ge Ge24 1 0.54040088 0.37959093 0.75000000 1.0 Ge Ge25 1 0.04039627 0.12043985 0.75000000 1.0 Ge Ge26 1 0.45961092 0.62041324 0.25000000 1.0 Ge Ge27 1 0.95958937 0.87954170 0.25000000 1.0 Ge Ge28 1 0.67511972 0.03937269 0.54179982 1.0 Ge Ge29 1 0.17512330 0.46063972 0.95820311 1.0 Ge Ge30 1 0.32487820 0.96062068 0.04182966 1.0 Ge Ge31 1 0.82489020 0.53937787 0.45817237 1.0 Ge Ge32 1 0.32487820 0.96062068 0.45817034 1.0 Ge Ge33 1 0.82489020 0.53937787 0.04182763 1.0 Ge Ge34 1 0.67511972 0.03937269 0.95820018 1.0 Ge Ge35 1 0.17512330 0.46063972 0.54179689 1.0