# generated using pymatgen data_V6Ga3CuN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.53016366 _cell_length_b 6.53115534 _cell_length_c 6.53291543 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.18274666 _symmetry_Int_Tables_number 1 _chemical_formula_structural V6Ga3CuN2 _chemical_formula_sum 'V12 Ga6 Cu2 N4' _cell_volume 278.62424571 _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 V V0 1 0.78982280 0.95974594 0.37545684 1.0 V V1 1 0.71017720 0.04025406 0.87545684 1.0 V V2 1 0.20792111 0.45807119 0.12610674 1.0 V V3 1 0.29207889 0.54192881 0.62610674 1.0 V V4 1 0.95877642 0.37650042 0.79063913 1.0 V V5 1 0.04021855 0.87306639 0.70990073 1.0 V V6 1 0.45978145 0.12693361 0.20990073 1.0 V V7 1 0.54122358 0.62349958 0.29063913 1.0 V V8 1 0.37634698 0.78932777 0.95867793 1.0 V V9 1 0.87343523 0.70872047 0.04101368 1.0 V V10 1 0.12365302 0.21067223 0.45867793 1.0 V V11 1 0.62656477 0.29127953 0.54101368 1.0 Ga Ga12 1 0.82299427 0.31976512 0.17797947 1.0 Ga Ga13 1 0.67700573 0.68023488 0.67797947 1.0 Ga Ga14 1 0.56134257 0.41999794 0.92624639 1.0 Ga Ga15 1 0.41796139 0.93500191 0.57093223 1.0 Ga Ga16 1 0.93865743 0.58000206 0.42624639 1.0 Ga Ga17 1 0.08203861 0.06499809 0.07093223 1.0 Cu Cu18 1 0.18287036 0.82232767 0.31855214 1.0 Cu Cu19 1 0.31712964 0.17767233 0.81855214 1.0 N N20 1 0.87729022 0.12405406 0.62656284 1.0 N N21 1 0.62270978 0.87594594 0.12656284 1.0 N N22 1 0.12594346 0.62442833 0.87793088 1.0 N N23 1 0.37405654 0.37557167 0.37793088 1.0