# generated using pymatgen data_Ti4V4SiAs3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.40257168 _cell_length_b 6.51838643 _cell_length_c 7.91369713 _cell_angle_alpha 90.06240674 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti4V4SiAs3 _chemical_formula_sum 'Ti4 V4 Si1 As3' _cell_volume 175.51997696 _cell_formula_units_Z 1 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 Ti Ti0 1 0.25000000 0.55339986 0.16285081 1.0 Ti Ti1 1 0.75000000 0.45477838 0.83300537 1.0 Ti Ti2 1 0.75000000 0.94484230 0.67053008 1.0 Ti Ti3 1 0.25000000 0.05198061 0.33318020 1.0 V V4 1 0.25000000 0.62856808 0.56151667 1.0 V V5 1 0.75000000 0.36948489 0.44062409 1.0 V V6 1 0.75000000 0.86995570 0.05749152 1.0 V V7 1 0.25000000 0.12592941 0.93989318 1.0 Si Si8 1 0.25000000 0.74917848 0.86051820 1.0 As As9 1 0.75000000 0.25314704 0.13864778 1.0 As As10 1 0.75000000 0.75153891 0.36083089 1.0 As As11 1 0.25000000 0.24719534 0.64091122 1.0