%chk=000222007.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222007

0 1
O 1.161405 0.271317 1.480633
O 0.881374 0.604386 -0.803860
O 3.562396 -1.935971 0.805010
O 3.224824 -1.669801 -1.313186
N 3.310627 -1.257887 -0.173073
C 3.176246 0.267254 0.049057
C 2.569280 0.527227 1.449207
C 2.268055 0.880777 -1.038336
C 4.608400 0.844770 -0.015004
C 0.404124 0.998106 0.494176
C 5.253404 0.746241 -1.391217
C -1.000175 0.493443 0.618561
C -1.921159 0.689090 -0.330332
C -3.309838 0.210203 -0.222840
C -3.593647 -1.082800 0.245752
C -4.363744 1.056861 -0.608284
C -4.918097 -1.520155 0.332368
C -5.685084 0.615361 -0.512751
C -5.964812 -0.672749 -0.043272
H 2.951202 -0.190100 2.210408
H 2.759818 1.564583 1.776482
H 2.419551 1.972196 -1.105841
H 2.428945 0.406648 -2.032743
H 5.245741 0.326114 0.735131
H 4.583597 1.907053 0.305832
H 0.537902 2.088387 0.638282
H 5.186321 -0.266891 -1.815888
H 4.794957 1.427562 -2.117405
H 6.321014 0.998377 -1.342476
H -1.194265 -0.056939 1.543880
H -1.681489 1.223214 -1.256388
H -2.779129 -1.748190 0.531452
H -4.151043 2.058689 -0.976205
H -5.133546 -2.524888 0.693248
H -6.499810 1.275122 -0.806674
H -6.995444 -1.014910 0.027100


%chk=000222007-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222007

0 1
O 1.251556 -0.397837 1.353741
O 0.826828 0.869245 -0.656007
O 3.745451 -2.088396 -0.290615
O 2.911337 -1.054033 -2.135065
N 3.259680 -1.066931 -0.901351
C 3.192311 0.269379 -0.087474
C 2.676410 -0.050759 1.338641
C 2.236483 1.259018 -0.789596
C 4.653192 0.802079 -0.013654
C 0.459311 0.688062 0.744248
C 5.313707 1.121318 -1.372009
C -0.989796 0.323091 0.864048
C -1.879354 0.416015 -0.161184
C -3.318183 0.090259 -0.113220
C -3.968695 -0.415558 1.049352
C -4.100036 0.288690 -1.286136
C -5.346925 -0.706063 1.035693
C -5.480934 -0.001863 -1.301516
C -6.111918 -0.500150 -0.138916
H 3.204589 -0.920423 1.755572
H 2.861019 0.846137 1.971568
H 2.402580 2.262870 -0.339164
H 2.421771 1.298131 -1.871184
H 5.258976 0.053105 0.531138
H 4.633462 1.716189 0.611671
H 0.711375 1.630866 1.298346
H 5.361542 0.233735 -2.026816
H 4.776791 1.917082 -1.918228
H 6.347958 1.471487 -1.207825
H -1.275947 -0.022825 1.864012
H -1.493828 0.763639 -1.128680
H -3.394295 -0.588632 1.966298
H -3.613243 0.672283 -2.191396
H -5.829585 -1.096612 1.938799
H -6.062215 0.157535 -2.216505
H -7.183477 -0.728430 -0.145781


