%chk=000268354.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268354

0 1
O 5.110536 3.092093 0.720797
N 5.400428 0.889531 0.190760
N 0.352950 0.470215 -0.285646
C 4.879333 -0.395851 -0.035993
C 3.479728 -0.615191 0.103522
C 2.629059 0.499608 0.472282
C 4.572130 2.013480 0.546982
C 3.146381 1.733394 0.677389
C 5.723633 -1.484595 -0.399061
C 2.961330 -1.911089 -0.140713
C 6.857315 1.137406 0.046084
C 1.171524 0.259564 0.687666
C 5.182162 -2.735396 -0.620748
C 3.792572 -2.956424 -0.493936
C -3.844798 0.007461 -0.074967
C -1.059292 0.287407 -0.144700
C -5.315951 -0.142611 -0.038289
C -3.178678 0.686635 0.957085
C -3.107868 -0.524794 -1.146973
C -1.790832 0.826733 0.929192
C -1.722396 -0.384803 -1.189751
C -5.933613 -0.768884 1.055980
C -6.099666 0.341265 -1.097974
C -7.323318 -0.910282 1.085997
C -7.489059 0.199548 -1.059707
C -8.102728 -0.426436 0.030229
H 2.532288 2.599124 0.934868
H 6.795561 -1.334186 -0.506032
H 1.885710 -2.076621 -0.053124
H 7.195121 0.927961 -0.981777
H 7.435195 0.529657 0.760582
H 7.076483 2.206661 0.259389
H 0.930782 -0.089087 1.707184
H 5.829320 -3.568683 -0.900045
H 3.388263 -3.948897 -0.680283
H -3.750344 1.113001 1.781860
H -3.625351 -1.050934 -1.949799
H -1.283053 1.369236 1.724169
H -1.148533 -0.783811 -2.026886
H -5.328174 -1.149583 1.876707
H -5.623517 0.833535 -1.944744
H -7.800049 -1.398954 1.934269
H -8.095123 0.578705 -1.881174
H -9.185058 -0.536507 0.056831


%chk=000268354-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268354

0 1
O 4.777824 3.024405 -0.992485
N 5.374073 0.858023 -0.283105
N 0.267328 0.759954 -0.400290
C 5.017670 -0.440104 0.121919
C 3.628214 -0.817601 0.208592
C 2.615030 0.184618 -0.130876
C 4.407986 1.861688 -0.627473
C 3.015370 1.451265 -0.524086
C 6.025546 -1.393952 0.448515
C 3.314958 -2.146209 0.618677
C 6.794946 1.250062 -0.374539
C 1.169399 -0.127242 -0.057390
C 5.677476 -2.693111 0.850835
C 4.315440 -3.077125 0.937076
C -3.963134 0.146077 -0.093860
C -1.120212 0.508703 -0.262858
C -5.438063 -0.042026 -0.005510
C -3.084285 -0.477471 0.837487
C -3.383442 0.972770 -1.098740
C -1.691066 -0.307272 0.758757
C -1.993782 1.165603 -1.172681
C -5.992819 -1.265284 0.465122
C -6.333897 0.994879 -0.389939
C -7.389509 -1.445642 0.548101
C -7.730826 0.815890 -0.307655
C -8.267138 -0.405740 0.161948
H 2.264184 2.203453 -0.776555
H 7.081021 -1.119855 0.387451
H 2.269492 -2.459798 0.687117
H 7.330811 0.621181 -1.107621
H 7.289842 1.169949 0.609735
H 6.814875 2.298136 -0.709454
H 0.881373 -1.142007 0.275688
H 6.467471 -3.410779 1.097241
H 4.045805 -4.091099 1.248540
H -3.503665 -1.068487 1.659356
H -4.028952 1.453560 -1.841624
H -1.047068 -0.761825 1.520765
H -1.551235 1.806945 -1.941184
H -5.326301 -2.091727 0.736980
H -5.934026 1.958607 -0.724749
H -7.793689 -2.399798 0.904492
H -8.400747 1.632156 -0.600208
H -9.351877 -0.545170 0.225994


