%chk=000290030.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290030

0 1
S -0.776447 2.195703 0.336484
O -4.262841 2.431511 1.457092
O -3.696170 1.536327 -0.546351
N 1.188545 -0.444126 -0.483641
N 2.144972 0.502890 -0.726616
C -0.082316 -0.206062 -0.674922
C -0.997485 -1.351511 -0.414906
C -0.717767 1.082068 -1.092465
C -0.943630 -2.026026 0.815076
C -1.919456 -1.752595 -1.394264
C 3.483823 0.154481 -0.333742
C -1.818700 -3.086179 1.066373
C -2.790612 -2.813476 -1.134848
C -2.744643 -3.478846 0.094969
C -2.123524 1.510166 1.320535
C 4.402030 1.209853 -0.157903
C 3.902189 -1.184298 -0.213791
C 5.735983 0.911273 0.125641
C 5.238457 -1.456417 0.075941
C 6.159265 -0.415563 0.245143
C -3.398669 1.796793 0.595374
C -5.562070 2.808109 0.924803
H -0.157520 1.595501 -1.900752
H -1.748369 0.935764 -1.501269
H -0.206510 -1.733470 1.562894
H -1.954652 -1.243363 -2.356373
H -1.774171 -3.610597 2.019593
H -3.506767 -3.123186 -1.894735
H 1.903169 1.499156 -0.635469
H -3.425830 -4.304228 0.293026
H -2.094338 1.981164 2.329389
H -2.004659 0.414763 1.484769
H 4.087091 2.245817 -0.244832
H 3.184949 -1.995197 -0.348026
H 6.450569 1.723251 0.257366
H 5.567480 -2.491249 0.169432
H 7.199095 -0.639025 0.468474
H -6.093521 3.156713 1.816562
H -5.428192 3.607208 0.189088
H -6.047557 1.938403 0.470480


%chk=000290030-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290030

0 1
S -0.683873 2.319101 -0.772331
O -3.658735 3.077426 1.400688
O -3.840009 1.418403 -0.222985
N 1.024830 -0.691227 -0.352886
N 1.902135 0.344042 -0.519940
C -0.220794 -0.580345 -0.820770
C -1.117438 -1.747256 -0.592074
C -0.697384 0.593930 -1.646443
C -0.559759 -3.024235 -0.285688
C -2.534797 -1.630932 -0.670147
C 3.234419 0.231957 -0.060454
C -1.387609 -4.142320 -0.073099
C -3.360629 -2.757123 -0.454493
C -2.796651 -4.017890 -0.159191
C -1.648551 1.924377 0.807332
C 4.076032 1.373949 -0.143569
C 3.742815 -0.986269 0.462553
C 5.414082 1.294274 0.294065
C 5.082300 -1.048394 0.897021
C 5.928256 0.084202 0.816898
C -3.140163 2.077850 0.581791
C -5.117074 3.328009 1.267655
H -0.002119 0.776521 -2.489867
H -1.706666 0.441434 -2.047499
H 0.528560 -3.116011 -0.224707
H -3.010613 -0.662649 -0.861324
H -0.936780 -5.115601 0.152566
H -4.448824 -2.642162 -0.513579
H 1.553350 1.281470 -0.775861
H -3.440610 -4.889754 0.001385
H -1.291338 2.617952 1.580822
H -1.406998 0.886386 1.093153
H 3.683467 2.316021 -0.547206
H 3.080807 -1.853221 0.524463
H 6.055385 2.180277 0.226595
H 5.469811 -1.990483 1.301664
H 6.968081 0.024972 1.154990
H -5.331381 4.121358 1.996541
H -5.351423 3.653698 0.240590
H -5.682910 2.409764 1.496940


