%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
O                 -3.597  -2.639   0.012                       
O                 -6.001  -1.569   1.334                       
O                 -6.237   0.624   0.856                       
N                 -2.247   1.231   0.267                       
N                  4.649  -1.228   0.756                       
N                  6.612  -0.253   0.003                       
C                 -1.976   2.607  -0.138                       
C                 -1.422   2.876  -1.513                       
C                 -2.851   3.231  -1.198                       
C                 -1.288   0.202   0.195                       
C                 -3.557   0.906   0.495                       
C                 -1.778  -1.122   0.084                       
C                  0.113   0.450   0.285                       
C                 -4.089  -0.351   0.560                       
C                 -3.224  -1.468   0.209                       
C                  0.997  -0.621   0.042                       
C                 -0.863  -2.170  -0.104                       
C                  0.654   1.767   0.810                       
C                  0.491  -1.922  -0.170                       
C                  2.473  -0.445   0.030                       
C                 -5.579  -0.452   0.941                       
C                  3.120   0.545  -0.742                       
C                  3.311  -1.301   0.747                       
C                  4.499   0.653  -0.776                       
C                  5.240  -0.279   0.011                       
C                  5.200   1.690  -1.615                       
C                  7.407  -1.066   0.908                       
H                 -1.652   3.261   0.664                       
H                 -1.252   2.019  -2.156                       
H                 -0.690   3.671  -1.612                       
H                 -3.117   4.274  -1.065                       
H                 -3.629   2.618  -1.642                       
H                 -4.232   1.745   0.609                       
H                 -1.266  -3.171  -0.207                       
H                  0.004   2.161   1.594                       
H                  1.639   1.609   1.253                       
H                  0.760   2.544   0.049                       
H                  1.187  -2.732  -0.366                       
H                  2.526   1.229  -1.342                       
H                  2.877  -2.082   1.370                       
H                  4.480   2.284  -2.182                       
H                  5.789   2.384  -1.000                       
H                  5.893   1.228  -2.330                       
H                  7.048   0.585  -0.348                       
H                  7.193  -2.126   0.755                       
H                  7.214  -0.834   1.964                       
H                  8.462  -0.886   0.694                       

charges.txt