%NProcShared=64
%Mem=54Gb
#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

+1 1
S                  1.236   0.518  -1.715                       
O                 -0.324  -0.435   2.076                       
O                 -3.592   0.513  -1.282                       
O                 -2.826   2.393  -0.254                       
O                  3.942   1.282   2.636                       
O                 -5.735  -0.125  -0.779                       
O                 -6.435  -1.420   0.808                       
O                 -5.044   0.301   1.355                       
N                 -0.378   1.101   0.267                       
N                  2.679   0.145   1.104                       
N                  6.026  -0.232   2.550                       
H                  5.668   0.574   3.099                       
C                  0.943   1.540  -0.218                       
C                 -0.605   0.546  -2.116                       
C                 -1.310   0.535  -0.697                       
C                  1.555   1.036   1.128                       
C                  0.153   0.400   1.346                       
C                 -0.957  -0.709  -2.920                       
C                 -0.922   1.818  -2.919                       
C                 -2.645   1.283  -0.695                       
C                  3.770   0.332   1.873                       
C                  4.831  -0.795   1.807                       
C                 -4.961   0.971  -1.253                       
C                  5.194  -1.303   0.430                       
C                 -5.430   1.298  -2.649                       
C                  5.213  -2.682   0.188                       
C                  5.529  -0.412  -0.602                       
C                  5.565  -3.168  -1.072                       
C                  5.887  -0.902  -1.857                       
C                 -5.676  -0.358   0.556                       
C                  5.904  -2.280  -2.093                       
C                 -6.495  -1.856   2.199                       
C                 -5.323  -2.759   2.541                       
H                  1.034   2.607  -0.426                       
H                 -1.516  -0.501  -0.407                       
H                  1.774   1.850   1.821                       
H                 -2.032  -0.727  -3.119                       
H                 -0.689  -1.620  -2.378                       
H                 -0.437  -0.708  -3.882                       
H                 -1.979   1.834  -3.204                       
H                 -0.329   1.834  -3.836                       
H                 -0.706   2.729  -2.354                       
H                  2.641  -0.660   0.490                       
H                  4.454  -1.618   2.419                       
H                 -5.027   1.809  -0.560                       
H                  6.460  -0.918   3.170                       
H                  6.746   0.109   1.908                       
H                 -4.852   2.136  -3.044                       
H                 -5.305   0.433  -3.305                       
H                 -6.485   1.581  -2.626                       
H                  4.954  -3.374   0.984                       
H                  5.505   0.662  -0.437                       
H                  5.575  -4.238  -1.252                       
H                  6.145  -0.209  -2.651                       
H                  6.179  -2.658  -3.073                       
H                 -7.446  -2.385   2.264                       
H                 -6.528  -0.972   2.838                       
H                 -5.435  -3.123   3.567                       
H                 -5.288  -3.623   1.872                       
H                 -4.377  -2.216   2.472                       

charges.txt