# generated using pymatgen data_Nb2VCoAs2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.57409568 _cell_length_b 6.48201969 _cell_length_c 7.59001515 _cell_angle_alpha 89.03068936 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb2VCoAs2 _chemical_formula_sum 'Nb4 V2 Co2 As4' _cell_volume 175.81543977 _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 Nb Nb0 1 0.25000000 0.54677774 0.16489158 1.0 Nb Nb1 1 0.75000000 0.45322226 0.83510842 1.0 Nb Nb2 1 0.75000000 0.98385922 0.66101945 1.0 Nb Nb3 1 0.25000000 0.01614078 0.33898055 1.0 V V4 1 0.75000000 0.85982082 0.06389752 1.0 V V5 1 0.25000000 0.14017918 0.93610248 1.0 Co Co6 1 0.25000000 0.64627183 0.56351361 1.0 Co Co7 1 0.75000000 0.35372817 0.43648639 1.0 As As8 1 0.25000000 0.76139838 0.85145594 1.0 As As9 1 0.75000000 0.23860162 0.14854406 1.0 As As10 1 0.75000000 0.71588989 0.38398597 1.0 As As11 1 0.25000000 0.28411011 0.61601403 1.0