# generated using pymatgen data_V12SiAs3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.70622908 _cell_length_b 4.70774976 _cell_length_c 9.40622074 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural V12SiAs3 _chemical_formula_sum 'V12 Si1 As3' _cell_volume 208.40186394 _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 V V0 1 0.50000000 0.00000000 0.37681277 1.0 V V1 1 0.50000000 0.00000000 0.87553486 1.0 V V2 1 0.75059066 0.50000000 0.00000000 1.0 V V3 1 0.75506844 0.50000000 0.50000000 1.0 V V4 1 0.00000000 0.75216807 0.25192362 1.0 V V5 1 0.00000000 0.75216807 0.74807638 1.0 V V6 1 0.50000000 0.00000000 0.12446514 1.0 V V7 1 0.50000000 0.00000000 0.62318723 1.0 V V8 1 0.24940934 0.50000000 0.00000000 1.0 V V9 1 0.24493156 0.50000000 0.50000000 1.0 V V10 1 0.00000000 0.24783193 0.25192362 1.0 V V11 1 0.00000000 0.24783193 0.74807638 1.0 Si Si12 1 0.00000000 0.00000000 0.50000000 1.0 As As13 1 0.50000000 0.50000000 0.25051328 1.0 As As14 1 0.50000000 0.50000000 0.74948672 1.0 As As15 1 0.00000000 0.00000000 0.00000000 1.0