%chk=000296622.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296622

0 1
O -0.405404 3.143949 0.208735
O 4.056751 -1.324843 0.004292
O 3.974770 0.826127 0.218171
N -2.207388 -0.503250 -0.313782
N 3.450513 -0.265610 0.075991
C -0.808916 -0.456470 -0.196855
C -0.165223 0.797235 -0.026161
C -2.941495 -1.800515 -0.413516
C -2.971171 0.678815 -0.193307
C -0.024666 -1.644888 -0.270015
C -0.941569 2.062871 0.065917
C 1.233357 0.856024 0.061637
C -2.397604 1.888985 -0.027784
C 1.986082 -0.317997 -0.015794
C 1.349447 -1.572716 -0.182612
C -3.226212 -2.387471 0.963356
H -2.341985 -2.512208 -1.030072
H -3.890070 -1.633017 -0.974540
H -4.058844 0.548345 -0.258197
H -0.506734 -2.613579 -0.397080
H 1.726372 1.834843 0.192276
H -2.988087 2.803361 0.044166
H 1.969116 -2.477256 -0.238935
H -2.304672 -2.571121 1.533517
H -3.849386 -1.723879 1.577229
H -3.754382 -3.346635 0.882463


%chk=000296622-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296622

0 1
O -0.363488 3.230985 0.167572
O 4.097453 -1.394231 0.033394
O 4.017124 0.880615 0.210832
N -2.235508 -0.488610 -0.280349
N 3.452270 -0.272820 0.086134
C -0.833659 -0.452516 -0.179447
C -0.174374 0.816457 -0.030561
C -2.978349 -1.774145 -0.397077
C -2.965269 0.698110 -0.213484
C -0.049246 -1.647144 -0.228091
C -0.941673 2.099977 0.040564
C 1.235521 0.863919 0.054981
C -2.389629 1.939970 -0.065177
C 1.976666 -0.323736 -0.003382
C 1.344230 -1.585682 -0.144134
C -3.183775 -2.479311 0.959556
H -2.448679 -2.430055 -1.109697
H -3.957121 -1.544068 -0.852492
H -4.049781 0.577724 -0.293540
H -0.524849 -2.625158 -0.330534
H 1.720503 1.838702 0.166972
H -3.016866 2.833736 -0.027674
H 1.958970 -2.488513 -0.182338
H -2.223355 -2.731460 1.440443
H -3.753750 -1.837719 1.653739
H -3.750768 -3.415926 0.812887


