%chk=000217423.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217423

0 1
O -1.305979 2.917025 -1.352212
O 3.894991 -1.589221 0.466300
N -3.010443 -0.702373 0.003471
C -0.777129 0.258421 0.346996
C -1.122912 -0.628003 1.577042
C -1.760693 -0.298747 -0.727484
C -2.627673 -0.921274 1.443692
C -1.027136 1.746868 0.713537
C 0.652710 0.111349 -0.163205
C -3.631021 -1.912269 -0.606183
C -1.820271 2.511291 -0.331542
C 1.584496 -0.720121 0.477303
C 1.034231 0.827593 -1.305851
C 2.876507 -0.815947 -0.051581
C 2.332623 0.714116 -1.818370
C -3.269535 2.734893 -0.026630
C 3.271470 -0.108047 -1.203701
C 3.625096 -2.362192 1.658708
H -0.875943 -0.136462 2.529720
H -0.544103 -1.569910 1.557045
H -2.039333 0.444462 -1.500002
H -1.278970 -1.137389 -1.273129
H -2.876773 -1.931791 1.815640
H -3.231408 -0.200871 2.035813
H -0.052774 2.260476 0.863067
H -1.541378 1.809094 1.691967
H -4.569474 -2.136639 -0.074015
H -3.002413 -2.814747 -0.600007
H -3.899340 -1.686000 -1.651527
H 1.306102 -1.277925 1.364808
H 0.322283 1.500872 -1.795303
H 2.609482 1.279965 -2.708965
H -3.424711 3.282865 0.908409
H -3.769966 3.293741 -0.829623
H -3.792599 1.764002 0.073058
H 4.284172 -0.212757 -1.582156
H 3.368811 -1.701131 2.491274
H 4.592046 -2.853137 1.831148
H 2.841559 -3.099778 1.464788


%chk=000217423-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217423

0 1
O -0.315710 3.020763 -0.354978
O 4.143227 -0.851809 0.702621
N -3.148402 -0.655425 0.053009
C -0.834093 -0.155969 0.254469
C -1.138980 -1.360354 1.216742
C -1.971342 -0.346926 -0.787419
C -2.680702 -1.575145 1.133974
C -1.028866 1.179053 1.084898
C 0.572705 -0.211079 -0.351828
C -4.346750 -1.103567 -0.668638
C -1.264624 2.420512 0.219607
C 1.679486 -0.519610 0.485568
C 0.805686 0.059856 -1.719883
C 2.988826 -0.556529 -0.045436
C 2.120053 0.018336 -2.243956
C -2.708849 2.895508 0.103294
C 3.215575 -0.289685 -1.418823
C 3.978697 -1.094253 2.135602
H -0.800358 -1.159189 2.248209
H -0.603995 -2.257219 0.857545
H -2.161928 0.545350 -1.410805
H -1.700097 -1.187220 -1.476015
H -2.902244 -2.640038 0.885622
H -3.200761 -1.341979 2.082463
H -0.115888 1.336760 1.687549
H -1.891646 1.040545 1.759199
H -5.186595 -1.229227 0.038287
H -4.199288 -2.075961 -1.203663
H -4.644096 -0.345010 -1.415182
H 1.506776 -0.728027 1.546727
H -0.025409 0.323956 -2.380497
H 2.289570 0.237624 -3.303879
H -3.000394 3.393460 1.050190
H -2.818364 3.617458 -0.721503
H -3.389468 2.032316 -0.018437
H 4.239715 -0.322866 -1.802205
H 3.547877 -0.211439 2.648060
H 4.994062 -1.282390 2.514796
H 3.341197 -1.980279 2.327016


