%chk=000206338.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206338

0 1
O -2.114414 3.754355 0.202009
O -2.923912 1.114885 -0.057458
N 0.754482 1.452927 0.280064
N 3.420533 0.321968 0.281893
N -7.059740 -2.184723 2.280128
C 1.969682 2.330675 0.330585
C 1.042865 0.153297 0.969645
C 3.136113 1.627393 -0.391683
C 2.209365 -0.555937 0.252345
C -0.433604 2.138055 0.875137
C -1.236720 2.744855 -0.297790
C 4.681283 -0.290069 0.022243
C -2.033179 1.679754 -1.071088
C 5.792755 0.492625 -0.369609
C 4.875107 -1.669139 0.271624
C 7.051249 -0.091938 -0.496980
C 6.141980 -2.233905 0.138393
C 7.236902 -1.455389 -0.249011
C -3.802570 0.132060 -0.441638
C -4.612288 -0.316157 0.622473
C -3.915880 -0.401829 -1.732626
C -5.546276 -1.320125 0.359124
C -4.862934 -1.405381 -1.960117
C -5.679889 -1.871269 -0.928201
C -6.385352 -1.798737 1.424574
H 2.273921 2.587278 1.369750
H 1.737731 3.284340 -0.190148
H 0.135214 -0.485651 0.907009
H 1.288300 0.280740 2.047053
H 2.889799 1.486562 -1.467786
H 4.040320 2.276328 -0.338751
H 2.431876 -1.511696 0.780250
H 1.916384 -0.811887 -0.790345
H -1.078035 1.423927 1.433834
H -0.179742 2.945084 1.595767
H -0.578340 3.312607 -0.998765
H -1.374601 0.881745 -1.457707
H -2.647731 2.125189 -1.870733
H 5.676341 1.557851 -0.557808
H 4.041272 -2.293895 0.584862
H -2.847649 3.351401 0.720781
H 7.899848 0.523755 -0.795158
H 6.278048 -3.296779 0.338174
H 8.219927 -1.903734 -0.353635
H -4.498907 0.120322 1.613237
H -3.289549 -0.054162 -2.548561
H -4.963208 -1.829699 -2.960976
H -6.414380 -2.652879 -1.115378


%chk=000206338-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206338

0 1
O -2.257219 3.875452 0.313790
O -2.951216 1.189510 -0.003848
N 0.730849 1.549991 0.476960
N 3.349395 0.332459 0.246312
N -7.244669 -2.382163 1.922759
C 1.912551 2.360174 0.092106
C 1.151684 0.466630 1.397905
C 2.955219 1.475586 -0.609656
C 2.193125 -0.448094 0.726863
C -0.399387 2.365473 0.983771
C -1.276234 2.899848 -0.177241
C 4.584448 -0.327076 0.005485
C -1.965319 1.768298 -0.947941
C 5.754036 0.417089 -0.342473
C 4.718597 -1.742735 0.139239
C 6.990585 -0.225997 -0.542983
C 5.966231 -2.374412 -0.053846
C 7.114478 -1.628620 -0.399131
C -3.744560 0.123212 -0.440188
C -4.672037 -0.370236 0.506773
C -3.658067 -0.459315 -1.730090
C -5.516608 -1.452949 0.160531
C -4.508766 -1.539060 -2.060992
C -5.438224 -2.045102 -1.132657
C -6.460390 -1.958430 1.125525
H 2.379228 2.840669 0.988302
H 1.598804 3.163270 -0.599503
H 0.266662 -0.138319 1.667238
H 1.592276 0.877999 2.340305
H 2.521688 1.106650 -1.568384
H 3.837850 2.086031 -0.853656
H 2.538058 -1.180223 1.477170
H 1.704459 -1.006436 -0.106360
H -1.030452 1.734299 1.636865
H -0.063327 3.238915 1.587997
H -0.648697 3.467888 -0.887120
H -1.216885 1.005796 -1.236058
H -2.498230 2.163051 -1.833974
H 5.709370 1.507680 -0.425988
H 3.849057 -2.364091 0.371926
H -2.981447 3.366017 0.762982
H 7.868727 0.377593 -0.801154
H 6.032980 -3.463453 0.054614
H 8.078928 -2.123482 -0.552758
H -4.725750 0.090250 1.497157
H -2.943886 -0.087360 -2.469511
H -4.440328 -1.986936 -3.057743
H -6.095188 -2.880346 -1.390319


