%chk=000214798.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214798

0 1
O -1.781560 -1.080306 -1.321348
O -0.005551 -4.098339 -0.688584
O 0.462789 1.948657 0.098717
N 2.036398 -1.540840 -0.334623
N 4.501204 1.198897 0.458453
N 0.184001 0.756776 -1.811948
C -0.082713 -2.667020 -0.848259
C 0.736956 -1.976506 0.259453
C 2.688933 -0.459922 0.468549
C 3.928150 0.040173 -0.303442
C -1.596911 -2.405571 -0.745429
C 5.923069 1.430570 0.062682
C 3.696232 2.436347 0.236158
C -2.411728 -0.135225 -0.521427
C -1.717216 1.058080 -0.259208
C -3.725199 -0.344741 -0.078547
C -2.391655 2.073454 0.440282
C -4.369271 0.681515 0.613341
C -3.707168 1.889618 0.868364
C -0.283897 1.282493 -0.612075
H 0.287633 -2.390522 -1.863441
H 0.845266 -2.662170 1.127530
H 0.185307 -1.085803 0.637825
H 2.983063 -0.780317 1.490243
H 1.968665 0.386050 0.605353
H 4.687806 -0.767437 -0.360906
H 3.653019 0.290737 -1.349877
H 2.668750 -2.347344 -0.393277
H -1.981228 -2.470944 0.282847
H -2.166195 -3.088885 -1.403719
H 6.519032 0.542513 0.324802
H 6.322351 2.271329 0.653199
H 6.078782 1.656441 -1.001893
H 4.016373 3.198736 0.962662
H 2.623827 2.230564 0.438128
H 3.766468 2.862634 -0.773671
H 0.879041 -4.422172 -0.944399
H -4.233279 -1.280930 -0.296053
H -1.859659 3.006029 0.657027
H -5.395943 0.542080 0.955165
H -4.218227 2.685946 1.407560
H 1.188877 0.704606 -1.944860
H -0.341891 0.038446 -2.298856


%chk=000214798-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214798

0 1
O -1.683168 -0.020948 -0.378087
O 1.069565 -2.421949 -0.810286
O -3.567076 3.748449 0.238574
N 2.447719 -0.974101 0.894516
N 5.857746 0.288772 -0.213424
N -1.566527 2.641335 -0.135930
C 0.464527 -1.119445 -0.558245
C 1.016034 -0.586023 0.801705
C 3.407501 -0.057434 0.225786
C 4.824642 -0.665161 0.249174
C -1.049670 -1.342838 -0.551040
C 7.221423 -0.161484 0.137396
C 5.746281 0.618293 -1.650262
C -3.089924 0.055471 -0.292370
C -3.676269 1.344199 -0.097030
C -3.904604 -1.099253 -0.391898
C -5.088452 1.422039 -0.000747
C -5.307377 -0.984054 -0.294755
C -5.906496 0.279760 -0.096389
C -2.938717 2.663590 0.017925
H 0.720306 -0.408885 -1.375147
H 0.472839 -1.084149 1.626109
H 0.852165 0.508072 0.893570
H 3.442714 0.946297 0.704983
H 3.065274 0.082349 -0.815728
H 5.071159 -0.937800 1.295601
H 4.820853 -1.617143 -0.342069
H 2.734281 -1.182757 1.858929
H -1.330662 -2.014671 0.283478
H -1.367558 -1.794653 -1.509583
H 7.295526 -0.314649 1.228903
H 7.951898 0.616662 -0.146973
H 7.520015 -1.114773 -0.368351
H 6.529031 1.349589 -1.918349
H 4.769688 1.083338 -1.867091
H 5.862533 -0.274784 -2.316088
H 1.921120 -2.373494 -0.255632
H -3.458887 -2.085242 -0.546896
H -5.509291 2.421529 0.153015
H -5.925961 -1.884828 -0.374925
H -6.994347 0.372093 -0.019456
H -1.072009 3.530055 -0.075673
H -1.085145 1.756324 -0.314744


