%NProcShared=64 %Mem=54Gb #B3LYP/6-31G(d,p) SCF=Tight Pop=(ESP,Dipole,Regular,ReadRadii) Iop(6/33=2) Iop(6/42=6) Iop(6/50=1) gfinput partial charges 0 1 As -1.723 0.420 1.262 O -0.096 0.907 1.734 H 0.463 0.114 1.768 O -1.879 0.881 -0.432 H -1.821 0.076 -0.973 O -2.004 -1.177 1.512 O -5.909 3.450 0.158 O -6.736 4.302 1.979 O -5.086 4.669 3.977 H -4.680 4.915 4.823 N -5.854 3.700 1.367 C -2.754 1.772 2.100 C -3.885 2.274 1.470 C -4.678 3.235 2.099 C -4.340 3.728 3.382 C -3.181 3.216 3.994 C -2.404 2.255 3.372 H -4.174 1.941 0.482 H -2.898 3.592 4.973 H -1.515 1.886 3.871 As 1.85 charges.txt