%chk=000221712.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221712

0 1
O 3.251745 0.984197 -1.076989
O 3.364651 -0.888078 0.328198
C 2.597450 0.276360 -0.010850
C 1.296926 -0.249266 -0.611908
C 4.621845 1.370480 -0.841786
C 4.736378 -0.613509 0.724650
C 5.440820 0.145246 -0.408780
C 0.067064 0.241005 0.155452
C -1.226584 -0.300206 -0.468596
C -2.463897 0.187592 0.296915
C -3.757440 -0.353314 -0.327183
C -4.995781 0.133908 0.437283
C 4.690745 2.531292 0.146841
C 5.321844 -1.994643 0.978386
C -6.288884 -0.407053 -0.187105
C -7.528724 0.078858 0.576827
C -8.818800 -0.456277 -0.040871
H 2.510627 0.935442 0.872014
H 1.246681 0.058531 -1.679393
H 1.336286 -1.360640 -0.629160
H 4.915918 1.705549 -1.865350
H 4.700887 -0.004833 1.655505
H 5.553408 -0.530611 -1.281562
H 6.461220 0.437534 -0.109231
H 0.132581 -0.075154 1.215251
H 0.044017 1.348591 0.164056
H -1.203496 -1.407276 -0.481598
H -1.291997 0.011955 -1.529055
H -2.486878 1.294379 0.309631
H -2.398558 -0.125186 1.356909
H -3.734846 -1.460147 -0.340281
H -3.822993 -0.041214 -1.387402
H -5.018513 1.240653 0.450152
H -4.930422 -0.178504 1.497327
H 5.665191 3.029446 0.109625
H 4.522706 2.218268 1.181935
H 3.924998 3.281318 -0.093053
H 4.786498 -2.501245 1.792209
H 5.213944 -2.637192 0.093279
H 6.382721 -1.946006 1.239705
H -6.355839 -0.095206 -1.247090
H -6.267425 -1.513684 -0.201317
H -7.464136 -0.234853 1.637089
H -7.552305 1.186110 0.590201
H -8.932673 -0.131962 -1.081494
H -8.844670 -1.551876 -0.035159
H -9.697692 -0.104379 0.510575


%chk=000221712-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221712

0 1
O 3.674164 0.771189 -1.539743
O 2.920291 -0.510669 0.372007
C 2.678215 0.662558 -0.472561
C 1.313978 0.503142 -1.133809
C 5.073593 0.853705 -1.030946
C 4.247448 -0.420765 1.035482
C 5.340506 -0.318469 -0.051250
C 0.150421 0.459267 -0.119821
C -1.220307 0.245349 -0.799294
C -2.388203 0.152736 0.208261
C -3.761771 -0.073735 -0.462557
C -4.920975 -0.212305 0.550477
C 5.391267 2.248908 -0.454031
C 4.377755 -1.663600 1.915512
C -6.297148 -0.434751 -0.116402
C -7.450330 -0.598772 0.900524
C -8.822650 -0.815672 0.226775
H 2.728673 1.572119 0.174292
H 1.182313 1.342012 -1.843540
H 1.339266 -0.429136 -1.728792
H 5.673039 0.707621 -1.947031
H 4.254652 0.495556 1.670163
H 5.344441 -1.266055 -0.621518
H 6.335325 -0.194675 0.419626
H 0.340238 -0.354745 0.605417
H 0.125805 1.404073 0.463612
H -1.185816 -0.685201 -1.403653
H -1.414531 1.072697 -1.514059
H -2.425363 1.081494 0.815657
H -2.188243 -0.675259 0.920326
H -3.715399 -0.987523 -1.091484
H -3.976769 0.767916 -1.154013
H -4.964250 0.697564 1.185468
H -4.705906 -1.058708 1.236268
H 6.480143 2.348446 -0.287312
H 4.885811 2.441472 0.508953
H 5.079385 3.028703 -1.170173
H 3.558114 -1.699720 2.653578
H 4.324316 -2.576229 1.296018
H 5.341497 -1.659234 2.456662
H -6.522597 0.418959 -0.789564
H -6.250714 -1.335863 -0.763474
H -7.225092 -1.454770 1.569165
H -7.492682 0.299510 1.550018
H -9.084930 0.041643 -0.421833
H -8.813275 -1.722982 -0.406660
H -9.629105 -0.933401 0.974058


