%chk=000190209.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190209

0 1
O 0.192001 0.259543 0.160825
O 2.828051 0.979625 -2.005416
O -0.428657 -3.780598 -0.242577
C -1.097520 -0.249842 0.063432
C -2.128309 0.747477 0.109983
C -1.359112 -1.599562 -0.076130
C -3.470371 0.293912 0.004844
C 1.259969 -0.647378 0.134881
C -2.721308 -2.022356 -0.176307
C -3.740112 -1.109196 -0.139127
C -0.252271 -2.586302 -0.116503
C 2.510221 0.095998 0.310446
C 1.080668 -1.972755 0.003794
C -1.852991 2.138708 0.258617
C -4.521449 1.260865 0.046746
C 3.173069 0.820904 -0.693018
C -2.885643 3.044362 0.296084
C -4.233202 2.597705 0.188160
C 3.085191 0.072259 1.605898
C 4.385895 1.508212 -0.415957
C 4.267132 0.740066 1.879614
C 4.918540 1.463242 0.858767
C 1.622578 0.370580 -2.527175
H -2.907620 -3.096103 -0.283161
H -4.778091 -1.430115 -0.216217
H 1.924994 -2.665065 -0.014572
H -0.811421 2.455940 0.343517
H -5.551851 0.916998 -0.034277
H -2.690911 4.109564 0.409691
H -5.033634 3.337736 0.220956
H 2.576226 -0.488239 2.393886
H 4.868445 2.057267 -1.223834
H 4.698072 0.711546 2.878133
H 5.849038 1.988276 1.081776
H 0.741002 0.776582 -2.018181
H 1.683135 -0.719509 -2.453519
H 1.651746 0.693053 -3.577177


%chk=000190209-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190209

0 1
O 0.196329 0.224360 0.149273
O 2.250480 1.694068 -1.517424
O -0.505655 -3.887466 0.319708
C -1.122327 -0.262992 0.106910
C -2.148345 0.737273 0.003768
C -1.403412 -1.637960 0.170103
C -3.519927 0.280095 -0.032036
C 1.268416 -0.683478 0.222203
C -2.774004 -2.061260 0.132618
C -3.801142 -1.131797 0.035520
C -0.296876 -2.628855 0.263661
C 2.576916 -0.001860 0.328080
C 1.047375 -2.042215 0.270682
C -1.860003 2.137290 -0.063953
C -4.562258 1.256044 -0.135016
C 2.961866 1.139936 -0.445123
C -2.903365 3.062831 -0.165190
C -4.262229 2.620410 -0.200505
C 3.475382 -0.462457 1.335581
C 4.168650 1.821265 -0.145012
C 4.687153 0.196721 1.606449
C 5.022814 1.361430 0.873080
C 1.514266 0.822355 -2.451529
H -2.961416 -3.138440 0.183298
H -4.846020 -1.460919 0.008012
H 1.901010 -2.724221 0.298048
H -0.817546 2.467918 -0.031988
H -5.603797 0.915197 -0.161751
H -2.681108 4.133939 -0.216086
H -5.069260 3.356970 -0.278730
H 3.178797 -1.326745 1.939612
H 4.420171 2.696211 -0.751917
H 5.349830 -0.175950 2.393610
H 5.953729 1.898794 1.083653
H 0.447651 0.778064 -2.178016
H 1.942655 -0.196336 -2.472675
H 1.626699 1.295180 -3.440017


