# generated using pymatgen data_TaTe4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 13.26865300 _cell_length_b 13.26865300 _cell_length_c 20.91790400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaTe4 _chemical_formula_sum 'Ta24 Te96' _cell_volume 3682.74661314 _cell_formula_units_Z 24 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 Ta Ta0 1 0.00000000 0.00000000 0.40294600 1.0 Ta Ta1 1 0.50000000 0.00000000 0.91816300 1.0 Ta Ta2 1 0.00000000 0.00000000 0.90294600 1.0 Ta Ta3 1 0.50000000 0.50000000 0.90294600 1.0 Ta Ta4 1 0.50000000 0.50000000 0.09705400 1.0 Ta Ta5 1 0.50000000 0.00000000 0.76463300 1.0 Ta Ta6 1 0.00000000 0.50000000 0.73536700 1.0 Ta Ta7 1 0.00000000 0.50000000 0.08183700 1.0 Ta Ta8 1 0.00000000 0.00000000 0.59705400 1.0 Ta Ta9 1 0.00000000 0.50000000 0.43034900 1.0 Ta Ta10 1 0.00000000 0.50000000 0.58183700 1.0 Ta Ta11 1 0.50000000 0.00000000 0.41816300 1.0 Ta Ta12 1 0.50000000 0.00000000 0.06965100 1.0 Ta Ta13 1 0.00000000 0.50000000 0.93034900 1.0 Ta Ta14 1 0.00000000 0.00000000 0.25000000 1.0 Ta Ta15 1 0.00000000 0.00000000 0.75000000 1.0 Ta Ta16 1 0.50000000 0.50000000 0.40294600 1.0 Ta Ta17 1 0.50000000 0.00000000 0.26463300 1.0 Ta Ta18 1 0.50000000 0.50000000 0.59705400 1.0 Ta Ta19 1 0.50000000 0.50000000 0.25000000 1.0 Ta Ta20 1 0.00000000 0.50000000 0.23536700 1.0 Ta Ta21 1 0.00000000 0.00000000 0.09705400 1.0 Ta Ta22 1 0.50000000 0.50000000 0.75000000 1.0 Ta Ta23 1 0.50000000 0.00000000 0.56965100 1.0 Te Te24 1 0.07845600 0.33742100 0.50208400 1.0 Te Te25 1 0.56864500 0.83394300 0.83693100 1.0 Te Te26 1 0.57761200 0.33727300 0.83107300 1.0 Te Te27 1 0.05888600 0.15456500 0.00062100 1.0 Te Te28 1 0.07845600 0.66257900 0.00208400 1.0 Te Te29 1 0.93135500 0.33394300 0.66306900 1.0 Te Te30 1 0.33727300 0.57761200 0.66892700 1.0 Te Te31 1 0.07285200 0.83608600 0.83026400 1.0 Te Te32 1 0.66391400 0.42714800 0.33026400 1.0 Te Te33 1 0.56283500 0.84776300 0.16748700 1.0 Te Te34 1 0.16391400 0.92714800 0.66973600 1.0 Te Te35 1 0.66605700 0.06864500 0.83693100 1.0 Te Te36 1 0.65223700 0.06283500 0.16748700 1.0 Te Te37 1 0.42238800 0.33727300 0.33107300 1.0 Te Te38 1 0.33394300 0.93135500 0.83693100 1.0 Te Te39 1 0.42154400 0.83742100 0.99791600 1.0 Te Te40 1 0.15223700 0.56283500 0.83251300 1.0 Te Te41 1 0.33608600 0.57285200 0.33026400 1.0 Te Te42 1 0.05888600 0.84543500 0.50062100 1.0 Te Te43 1 0.44111400 0.34543500 0.99937900 1.0 Te Te44 1 0.93716500 0.34776300 0.33251300 1.0 Te Te45 1 0.15456500 0.94111400 0.99937900 1.0 Te Te46 1 0.16272700 0.07761200 0.83107300 1.0 Te Te47 1 0.65456500 0.55888600 0.50062100 1.0 Te Te48 1 0.33742100 0.92154400 0.49791600 1.0 Te Te49 1 0.83727300 0.92238800 0.83107300 1.0 Te Te50 1 0.34543500 0.55888600 0.00062100 1.0 Te Te51 1 0.57761200 0.66272700 0.33107300 1.0 Te Te52 1 0.83742100 0.42154400 0.50208400 1.0 Te Te53 1 0.42714800 0.66391400 0.16973600 1.0 Te Te54 1 0.34543500 0.44111400 0.50062100 1.0 Te Te55 1 0.92714800 0.83608600 0.33026400 1.0 Te Te56 1 0.83742100 0.57845600 0.00208400 1.0 Te Te57 1 0.06864500 0.66605700 0.66306900 1.0 Te Te58 1 0.16605700 0.43135500 0.66306900 1.0 Te Te59 1 0.16391400 0.07285200 0.16973600 1.0 Te Te60 1 0.44111400 0.65456500 0.49937900 1.0 Te Te61 1 0.84543500 0.05888600 0.99937900 1.0 Te Te62 1 0.66272700 0.57761200 0.16892700 1.0 Te Te63 1 0.66391400 0.57285200 0.83026400 1.0 Te Te64 1 0.55888600 0.34543500 0.49937900 1.0 Te Te65 1 0.33608600 0.42714800 0.83026400 1.0 Te Te66 1 0.83608600 0.92714800 0.16973600 1.0 Te Te67 1 0.06864500 0.33394300 0.16306900 1.0 Te Te68 1 0.66257900 0.92154400 0.99791600 1.0 Te Te69 1 0.65456500 0.44111400 0.00062100 1.0 Te Te70 1 0.06283500 0.34776300 0.83251300 1.0 Te Te71 1 0.34776300 0.06283500 0.66748700 1.0 Te Te72 1 0.94111400 0.15456500 0.50062100 1.0 Te Te73 1 0.16272700 0.92238800 0.33107300 1.0 Te Te74 1 0.55888600 0.65456500 0.99937900 1.0 Te Te75 1 0.83394300 0.43135500 0.16306900 1.0 Te Te76 1 0.93716500 0.65223700 0.83251300 1.0 Te Te77 1 0.16257900 0.42154400 0.00208400 1.0 Te Te78 1 0.83394300 0.56864500 0.66306900 1.0 Te Te79 1 0.33727300 0.42238800 0.16892700 1.0 Te Te80 1 0.16257900 0.57845600 0.50208400 1.0 Te Te81 1 0.43716500 0.84776300 0.66748700 1.0 Te Te82 1 0.92238800 0.83727300 0.66892700 1.0 Te Te83 1 0.84776300 0.43716500 0.83251300 1.0 Te Te84 1 0.66605700 0.93135500 0.33693100 1.0 Te Te85 1 0.43716500 0.15223700 0.16748700 1.0 Te Te86 1 0.66272700 0.42238800 0.66892700 1.0 Te Te87 1 0.92714800 0.16391400 0.83026400 1.0 Te Te88 1 0.42714800 0.33608600 0.66973600 1.0 Te Te89 1 0.34776300 0.93716500 0.16748700 1.0 Te Te90 1 0.56864500 0.16605700 0.33693100 1.0 Te Te91 1 0.33394300 0.06864500 0.33693100 1.0 Te Te92 1 0.65223700 0.93716500 0.66748700 1.0 Te Te93 1 0.42238800 0.66272700 0.83107300 1.0 Te Te94 1 0.57285200 0.33608600 0.16973600 1.0 Te Te95 1 0.83727300 0.07761200 0.33107300 1.0 Te Te96 1 0.06283500 0.65223700 0.33251300 1.0 Te Te97 1 0.66257900 0.07845600 0.49791600 1.0 Te Te98 1 0.94111400 0.84543500 0.00062100 1.0 Te Te99 1 0.93135500 0.66605700 0.16306900 1.0 Te Te100 1 0.84776300 0.56283500 0.33251300 1.0 Te Te101 1 0.42154400 0.16257900 0.49791600 1.0 Te Te102 1 0.57845600 0.83742100 0.49791600 1.0 Te Te103 1 0.07761200 0.16272700 0.66892700 1.0 Te Te104 1 0.16605700 0.56864500 0.16306900 1.0 Te Te105 1 0.43135500 0.16605700 0.83693100 1.0 Te Te106 1 0.56283500 0.15223700 0.66748700 1.0 Te Te107 1 0.57285200 0.66391400 0.66973600 1.0 Te Te108 1 0.33742100 0.07845600 0.99791600 1.0 Te Te109 1 0.84543500 0.94111400 0.49937900 1.0 Te Te110 1 0.92154400 0.33742100 0.00208400 1.0 Te Te111 1 0.92154400 0.66257900 0.50208400 1.0 Te Te112 1 0.57845600 0.16257900 0.99791600 1.0 Te Te113 1 0.15223700 0.43716500 0.33251300 1.0 Te Te114 1 0.07285200 0.16391400 0.33026400 1.0 Te Te115 1 0.43135500 0.83394300 0.33693100 1.0 Te Te116 1 0.07761200 0.83727300 0.16892700 1.0 Te Te117 1 0.92238800 0.16272700 0.16892700 1.0 Te Te118 1 0.15456500 0.05888600 0.49937900 1.0 Te Te119 1 0.83608600 0.07285200 0.66973600 1.0