%chk=000270039.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270039

0 1
O -6.738087 0.131723 -0.029220
N 5.292642 -0.270962 -0.198200
N -1.184783 -0.269513 0.208061
C 3.893904 -0.028704 -0.145582
C 1.089480 0.332480 -0.288732
C 3.342368 1.132016 -0.744711
C 3.011041 -0.999235 0.387059
C 1.965008 1.299492 -0.815896
C 1.634875 -0.817641 0.310374
C 6.179604 0.915564 -0.341759
C 5.844739 -1.260378 0.766765
C -0.364120 0.548736 -0.379319
C -2.599887 -0.099223 0.122554
C -3.269396 0.236348 -1.073658
C -3.336343 -0.379383 1.291775
C -4.658738 0.303824 -1.104496
C -4.728137 -0.305280 1.277910
C -5.368910 0.036024 0.077519
H 3.992615 1.894218 -1.167055
H 3.399066 -1.903526 0.849899
H 1.562562 2.198102 -1.285243
H 0.961288 -1.575495 0.722882
H 5.886238 1.492198 -1.237244
H 7.217661 0.581436 -0.503904
H 6.160503 1.588665 0.529790
H 6.905656 -1.449182 0.534223
H 5.316381 -2.224035 0.652027
H 5.767587 -0.942264 1.818394
H -0.661976 1.438727 -0.961096
H -2.700145 0.427030 -1.982710
H -2.807847 -0.653920 2.206428
H -5.200545 0.554009 -2.014076
H -5.298665 -0.513479 2.177310
H -7.190839 -0.078170 0.822730


%chk=000270039-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270039

0 1
O -6.842889 0.189566 -0.151738
N 5.333190 -0.127020 0.045106
N -1.213333 -0.271762 0.344520
C 3.947998 0.032987 -0.023808
C 1.088113 0.356449 -0.160973
C 3.361050 1.136890 -0.725065
C 3.059951 -0.904786 0.606824
C 1.966707 1.284961 -0.785827
C 1.671722 -0.741587 0.535930
C 6.220206 0.846465 -0.605080
C 5.910473 -1.264584 0.774349
C -0.360511 0.540664 -0.243078
C -2.614713 -0.118521 0.185047
C -3.243263 0.410821 -0.984064
C -3.445806 -0.580336 1.242539
C -4.643939 0.501412 -1.075975
C -4.848168 -0.477524 1.165634
C -5.448017 0.068306 0.003834
H 3.994806 1.877361 -1.220732
H 3.464169 -1.762715 1.151694
H 1.544019 2.140764 -1.328685
H 0.998264 -1.458114 1.018012
H 6.042936 0.897226 -1.698487
H 7.268932 0.550823 -0.445763
H 6.086232 1.866115 -0.189873
H 7.009203 -1.216074 0.718035
H 5.589873 -2.234617 0.343738
H 5.623631 -1.255013 1.845368
H -0.695155 1.432549 -0.817873
H -2.631965 0.719029 -1.840065
H -2.962429 -1.010589 2.125091
H -5.132609 0.890553 -1.974435
H -5.470503 -0.828056 1.999775
H -7.313378 -0.151442 0.648824


