%chk=000226155.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226155

0 1
O -0.360617 0.524345 1.529494
O 1.734847 2.684439 -1.486797
O 0.973992 2.794261 0.613080
N -3.320518 -0.666639 -0.000275
C -0.568812 0.324810 0.127850
C -1.736732 1.203733 -0.364939
C -0.887997 -1.170383 -0.021226
C 0.736710 0.698495 -0.667552
C -3.056321 0.779165 0.298934
C -2.244513 -1.517011 0.611563
C -4.670651 -1.091068 0.503864
C 1.918798 -0.196214 -0.366880
C 1.135539 2.127402 -0.386455
C -5.772328 -0.492649 -0.371847
C 2.655279 -0.735570 -1.433194
C 2.295722 -0.480638 0.953414
C 3.757405 -1.555204 -1.175933
C 3.398680 -1.300290 1.203973
C 4.131569 -1.838604 0.141495
H -1.840265 1.110142 -1.464387
H -1.546879 2.271538 -0.151760
H -0.094121 -1.774011 0.463616
H -0.892644 -1.445003 -1.093990
H 0.490737 0.612063 -1.763225
H -3.007444 0.990668 1.390597
H -3.890256 1.382352 -0.119582
H -2.482006 -2.582663 0.406826
H -2.174023 -1.394778 1.716095
H -4.724100 -2.201518 0.443050
H -4.839491 -0.821796 1.569012
H -0.173276 1.476933 1.734820
H -5.878061 0.587129 -0.222233
H -5.553078 -0.651013 -1.437103
H -6.739992 -0.957094 -0.156279
H 2.376820 -0.513821 -2.462135
H 1.711390 -0.071252 1.784814
H 4.326737 -1.972273 -2.005081
H 3.686664 -1.518944 2.231387
H 2.042676 3.619099 -1.327892
H 4.991260 -2.476039 0.339083


%chk=000226155-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226155

0 1
O -0.407468 0.505401 1.608407
O 1.686099 2.830689 -1.409497
O 1.010193 2.778696 0.800152
N -3.342982 -0.675577 -0.066787
C -0.564538 0.341834 0.152133
C -1.747682 1.211219 -0.359127
C -0.888382 -1.148175 -0.073097
C 0.763342 0.741862 -0.607750
C -3.087382 0.753594 0.248103
C -2.262976 -1.521307 0.511303
C -4.682539 -1.135783 0.384568
C 1.966559 -0.168827 -0.324552
C 1.142107 2.184876 -0.303151
C -5.847339 -0.480385 -0.380428
C 2.498637 -0.961052 -1.372834
C 2.558024 -0.246195 0.963347
C 3.593066 -1.823988 -1.142284
C 3.653321 -1.108204 1.192921
C 4.174877 -1.900351 0.143916
H -1.812397 1.125844 -1.461295
H -1.575923 2.276011 -0.105360
H -0.104782 -1.764115 0.402125
H -0.885543 -1.357636 -1.159930
H 0.552051 0.691756 -1.690583
H -3.066692 0.925241 1.354494
H -3.901392 1.367742 -0.175116
H -2.485277 -2.578695 0.273678
H -2.219649 -1.422527 1.623985
H -4.720054 -2.229832 0.217606
H -4.819895 -0.974611 1.486462
H -0.102694 1.443209 1.768018
H -5.945885 0.596431 -0.154545
H -5.699061 -0.594233 -1.468953
H -6.802503 -0.963470 -0.103577
H 2.054535 -0.901995 -2.374087
H 2.153642 0.351585 1.784820
H 3.990673 -2.431602 -1.962896
H 4.098927 -1.162434 2.192634
H 1.962149 3.753872 -1.154239
H 5.025534 -2.566767 0.325617


