data_image0 _chemical_formula_structural TiTe2 _chemical_formula_sum "Ti1 Te2" _cell_length_a 3.7442470231571616 _cell_length_b 3.7442470231571616 _cell_length_c 18.458671858824488 _cell_angle_alpha 90.0 _cell_angle_beta 90.0 _cell_angle_gamma 120.00000000000001 _space_group_name_H-M_alt "P 1" _space_group_IT_number 1 loop_ _space_group_symop_operation_xyz '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 Ti Ti1 1.0 0.0 0.0 0.5000000000318416 1.0000 Te Te1 1.0 0.6666666657260205 0.3333333322952443 0.5945265208641546 1.0000 Te Te2 1.0 0.33333333383721064 0.6666666676744212 0.40547347919952886 1.0000