%chk=000271944.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271944

0 1
O 1.118991 0.774076 2.030406
N -0.676558 0.408680 -0.049983
N 0.667418 0.585545 -0.248113
C -7.105176 -0.376647 1.368227
C -5.643397 -0.137088 1.825189
C -7.095386 -0.485076 -0.178641
C -4.833444 -0.112223 0.560013
C -5.657636 -0.309700 -0.576461
C -3.467099 0.071761 0.424606
C -5.109005 -0.322476 -1.851043
C -2.906150 0.059133 -0.872083
C -3.724930 -0.136493 -1.994723
C -1.457007 0.249753 -1.085321
C 3.745533 -0.199721 0.152644
C 5.097981 0.009352 -0.228467
C 2.941180 0.944926 0.462993
C 3.240687 -1.538163 0.218055
C 5.618348 1.341315 -0.278917
C 3.465648 2.215800 0.414982
C 1.511784 0.762227 0.892025
C 5.916283 -1.120646 -0.550717
C 4.823574 2.414918 0.037772
C 4.049398 -2.601700 -0.093491
C 5.404054 -2.391475 -0.486583
H -7.756221 0.449260 1.696829
H -7.508874 -1.296522 1.820778
H -5.296591 -0.934943 2.506397
H -5.544103 0.811965 2.382271
H -7.735921 0.287474 -0.640128
H -7.488380 -1.460665 -0.516046
H -2.826458 0.224191 1.295532
H -5.732930 -0.473132 -2.727901
H -3.292852 -0.146228 -2.993150
H -1.135324 0.242696 -2.137465
H 2.208544 -1.701574 0.532720
H 6.659467 1.484599 -0.569717
H 2.855442 3.084830 0.668643
H 6.951431 -0.948670 -0.843584
H 5.215235 3.431262 0.009721
H 1.080214 0.585623 -1.189541
H 3.671866 -3.622952 -0.041270
H 6.019564 -3.256991 -0.728459


%chk=000271944-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271944

0 1
O 1.136045 1.551287 2.083470
N -0.649656 0.394772 0.227190
N 0.716932 0.487994 0.028776
C -7.286091 -0.097803 1.211012
C -5.856912 0.295747 1.724869
C -7.123194 -0.628232 -0.256734
C -4.918790 -0.022936 0.570687
C -5.633234 -0.541791 -0.543642
C -3.524902 0.140214 0.517090
C -4.945799 -0.899642 -1.723322
C -2.822071 -0.219663 -0.670336
C -3.544558 -0.737427 -1.783033
C -1.367211 -0.069900 -0.776810
C 3.715405 -0.086977 0.042834
C 5.101811 0.085487 -0.357448
C 3.022191 1.043511 0.624576
C 3.126463 -1.390944 -0.111541
C 5.754483 1.341325 -0.131785
C 3.714534 2.239308 0.869138
C 1.560855 1.037985 1.014460
C 5.807931 -1.014738 -0.948523
C 5.079971 2.393198 0.490566
C 3.845985 -2.445716 -0.679241
C 5.192992 -2.255418 -1.119546
H -7.964276 0.772527 1.238023
H -7.733197 -0.872544 1.857618
H -5.578424 -0.271350 2.633188
H -5.801625 1.366555 1.997970
H -7.704856 -0.021226 -0.977115
H -7.490469 -1.667632 -0.358703
H -2.954933 0.538736 1.363189
H -5.490222 -1.299588 -2.586632
H -3.000935 -1.012472 -2.696080
H -0.907234 -0.365459 -1.743612
H 2.113810 -1.574091 0.261729
H 6.799842 1.456433 -0.442183
H 3.177714 3.062318 1.351916
H 6.850764 -0.865402 -1.253084
H 5.588783 3.343901 0.680436
H 1.138780 0.198369 -0.868137
H 3.380177 -3.432736 -0.774518
H 5.742325 -3.089681 -1.568712


