# generated using pymatgen data_Ti4V4Si3As _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.35077503 _cell_length_b 6.53952670 _cell_length_c 7.90044625 _cell_angle_alpha 90.06142204 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti4V4Si3As _chemical_formula_sum 'Ti4 V4 Si3 As1' _cell_volume 173.11829305 _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 0.55109857 0.16645541 1.0 Ti Ti1 1 0.75000000 0.45136180 0.83663985 1.0 Ti Ti2 1 0.75000000 0.94338175 0.66618410 1.0 Ti Ti3 1 0.25000000 0.04957555 0.32960009 1.0 V V4 1 0.25000000 0.62921121 0.55972351 1.0 V V5 1 0.75000000 0.37539249 0.43835681 1.0 V V6 1 0.75000000 0.87506014 0.06029406 1.0 V V7 1 0.25000000 0.12632084 0.94177542 1.0 Si Si8 1 0.25000000 0.74894869 0.86160072 1.0 Si Si9 1 0.75000000 0.25186783 0.13992136 1.0 Si Si10 1 0.75000000 0.75088780 0.35972399 1.0 As As11 1 0.25000000 0.24689332 0.63972568 1.0