# generated using pymatgen data_Al3V6GaN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.58548459 _cell_length_b 6.58279349 _cell_length_c 6.58221558 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.08013584 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al3V6GaN2 _chemical_formula_sum 'Al6 V12 Ga2 N4' _cell_volume 285.34459194 _cell_formula_units_Z 2 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 Al Al0 1 0.17808604 0.81933987 0.31882797 1.0 Al Al1 1 0.31853686 0.17909383 0.82161447 1.0 Al Al2 1 0.82191396 0.31933987 0.18117203 1.0 Al Al3 1 0.68146314 0.67909383 0.67838553 1.0 Al Al4 1 0.57077381 0.42910216 0.93006154 1.0 Al Al5 1 0.42922619 0.92910216 0.56993846 1.0 V V6 1 0.79244777 0.95746037 0.37930016 1.0 V V7 1 0.70645840 0.04257697 0.87136338 1.0 V V8 1 0.20755223 0.45746037 0.12069984 1.0 V V9 1 0.29354160 0.54257697 0.62863662 1.0 V V10 1 0.95517734 0.37569953 0.79401743 1.0 V V11 1 0.04482266 0.87569953 0.70598257 1.0 V V12 1 0.45911287 0.12501742 0.20776967 1.0 V V13 1 0.54088713 0.62501742 0.29223033 1.0 V V14 1 0.37763832 0.79240826 0.95697905 1.0 V V15 1 0.87265949 0.70584114 0.04216361 1.0 V V16 1 0.12734051 0.20584114 0.45783639 1.0 V V17 1 0.62236168 0.29240826 0.54302095 1.0 Ga Ga18 1 0.93079441 0.56911252 0.42996156 1.0 Ga Ga19 1 0.06920559 0.06911252 0.07003844 1.0 N N20 1 0.87660709 0.12751946 0.62528700 1.0 N N21 1 0.62727638 0.87682847 0.12545359 1.0 N N22 1 0.12339291 0.62751946 0.87471300 1.0 N N23 1 0.37272362 0.37682847 0.37454641 1.0