%NProcShared=16 %Mem=16Gb #B3LYP/6-31G(d,p) SCF=Tight Pop=(ESP,Dipole,Regular) Iop(6/33=2) Iop(6/42=6) Iop(6/50=1) gfinput partial charges 0 1 Cl -5.318782 -3.827622 4.080133 F -6.714138 -5.317590 1.001170 F -1.507397 -2.767514 0.923888 O -1.585508 -7.682981 0.630912 O -4.261835 -10.662344 2.239704 O -2.126591 -10.402847 1.556168 N -3.529793 -1.960733 2.620232 N -2.129810 0.082952 0.905904 N -4.972335 -6.697273 2.747822 C -4.231891 0.262032 2.252519 C -4.955350 1.310035 3.068399 C -4.982680 1.376580 1.564154 C -2.716831 0.212275 2.309947 C -4.725445 -1.192660 2.234731 C -2.451136 -1.083747 3.078976 C -3.361997 -3.308546 2.307992 C -6.353213 -6.467025 3.139166 C -7.262811 -5.730811 2.194042 C -7.447702 -7.197626 2.374449 C -4.210116 -4.315484 2.805077 C -4.080109 -5.674234 2.404601 C -2.312968 -3.731300 1.465860 C -2.934429 -6.036231 1.653879 C -2.061171 -5.044352 1.183171 C -4.599544 -8.001840 2.540149 C -2.576090 -7.454507 1.342020 C -3.461358 -8.445219 1.931834 C -3.257397 -9.977462 1.894528 H -1.135753 0.325709 0.892158 H -2.209939 -0.884317 0.568481 H -2.608977 0.698001 0.242571 H -5.855223 0.992685 3.585900 H -4.360789 2.045745 3.601220 H -4.416588 2.168757 1.081309 H -5.900213 1.107151 1.050405 H -2.261617 1.098246 2.750005 H -5.063551 -1.506444 1.239729 H -5.560880 -1.326997 2.931115 H -2.527419 -0.870034 4.153390 H -1.465887 -1.514020 2.893338 H -6.513040 -6.308490 4.199681 H -7.970686 -5.008613 2.587052 H -7.142083 -7.822160 1.541285 H -8.300998 -7.559173 2.937748 H -1.219714 -5.345441 0.571124 H -5.305933 -8.746291 2.884672 charges.dat