%chk=000193430.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193430

1 1
O 2.671135 0.968245 0.428820
N -0.345211 0.841317 0.079750
C 0.656054 -0.341826 0.134770
C -1.702463 0.390653 0.645233
C 0.096324 -1.567116 -0.603655
C -2.259276 -0.834882 -0.079178
C -1.265314 -1.995912 -0.053810
C 0.155064 1.981961 0.943736
C -0.523972 1.352714 -1.332278
C 2.040690 0.033583 -0.442949
H 0.783295 -0.589061 1.225980
H -2.422824 1.239220 0.583293
H -1.576234 0.163914 1.730970
H 0.814618 -2.412328 -0.503028
H 0.028350 -1.382630 -1.695639
H -2.548345 -0.590195 -1.121855
H -3.212747 -1.139537 0.410977
H -1.161163 -2.396676 0.975820
H -1.661280 -2.846888 -0.650592
H 0.292309 1.672547 1.995124
H 1.153821 2.347644 0.605140
H -0.533204 2.844360 0.927345
H -0.870696 0.553607 -2.014170
H -1.268736 2.169234 -1.378434
H 0.422812 1.757428 -1.740613
H 1.977905 0.560990 -1.417336
H 2.666780 -0.869686 -0.577930
H 3.338109 0.531318 1.007606


%chk=000193430-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193430

1 1
O 2.641121 1.113375 0.173951
N -0.337458 0.843201 0.132501
C 0.661882 -0.373735 0.187349
C -1.752971 0.378522 0.578596
C 0.081742 -1.627848 -0.516088
C -2.291701 -0.826082 -0.197276
C -1.333002 -2.022703 -0.047678
C 0.084071 1.935139 1.128523
C -0.397500 1.462017 -1.258922
C 2.041212 -0.073398 -0.431819
H 0.778829 -0.561948 1.271234
H -2.403694 1.265144 0.486157
H -1.658380 0.125077 1.649873
H 0.786620 -2.457217 -0.320917
H 0.082954 -1.477115 -1.613799
H -2.455144 -0.580059 -1.263316
H -3.286455 -1.066065 0.220128
H -1.307315 -2.351248 1.009780
H -1.690808 -2.882425 -0.639517
H 0.087915 1.505409 2.142043
H 1.094467 2.276690 0.872227
H -0.652820 2.752032 1.071020
H -0.612946 0.690361 -2.010626
H -1.198941 2.217012 -1.268847
H 0.564672 1.948708 -1.473833
H 1.953230 0.046356 -1.531678
H 2.657020 -0.975698 -0.242464
H 3.609198 1.158499 -0.023506


