%chk=000200509.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200509

0 1
O 2.857091 0.725646 -0.378729
O 9.144259 0.688253 -0.225361
C -4.527459 0.332850 -0.263820
C -5.765880 -0.429175 0.226939
C -3.231691 -0.335465 0.215405
C -7.061532 0.239279 -0.252385
C -1.994333 0.427624 -0.276041
C -8.300411 -0.522326 0.237965
C -0.698314 -0.240469 0.203089
C -9.595676 0.146264 -0.241505
C 0.532864 0.526119 -0.290919
C -10.836040 -0.614502 0.248112
C 1.819578 -0.141307 0.187499
C -12.128194 0.046786 -0.226347
C 4.167290 0.418481 -0.143989
C 4.625001 -0.675644 0.606606
C 5.063173 1.332446 -0.744991
C 6.911604 0.037346 0.170172
C 6.002342 -0.852577 0.754554
C 6.423758 1.131597 -0.581182
C 8.386221 -0.105550 0.297120
C 8.921904 -1.264375 1.093443
H -4.565308 1.380563 0.092257
H -4.535347 0.390467 -1.369507
H -5.729456 -1.476741 -0.129354
H -5.759425 -0.486554 1.332530
H -3.225649 -0.392667 1.321089
H -3.195651 -1.383034 -0.141171
H -7.069005 0.296938 -1.357982
H -7.099029 1.286890 0.103753
H -2.032687 1.475708 0.079846
H -2.002668 0.485559 -1.382015
H -8.293747 -0.579728 1.343523
H -8.263680 -1.569844 -0.118335
H -0.663092 -1.288034 -0.155250
H -0.693134 -0.295913 1.309407
H -9.604248 0.204564 -1.346868
H -9.634363 1.193845 0.113989
H 0.537278 0.591230 -1.398523
H 0.507407 1.578624 0.059263
H -10.830130 -0.671620 1.354217
H -10.799970 -1.662387 -0.108819
H 1.923427 -0.139455 1.285088
H 1.954050 -1.157728 -0.217842
H -12.214198 1.075344 0.142056
H -13.007497 -0.502883 0.127533
H -12.183891 0.085460 -1.320171
H 3.938088 -1.375968 1.067061
H 4.669625 2.168284 -1.319338
H 6.360698 -1.702747 1.337830
H 7.146237 1.821344 -1.033811
H 8.619228 -2.228567 0.667715
H 8.589423 -1.231999 2.137930
H 10.023255 -1.247353 1.104262


%chk=000200509-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200509

0 1
O 2.979302 0.917628 -0.460973
O 9.380445 0.408560 -0.217296
C -4.571688 0.415792 -0.221530
C -5.809665 -0.366562 0.271803
C -3.233246 -0.191279 0.255867
C -7.147475 0.232648 -0.217194
C -1.996739 0.581250 -0.255534
C -8.385277 -0.559298 0.261562
C -0.657568 -0.036167 0.206776
C -9.722954 0.033951 -0.235122
C 0.569870 0.737171 -0.328145
C -10.959949 -0.765177 0.235138
C 1.888020 0.103166 0.117915
C -12.291867 -0.167878 -0.268233
C 4.297258 0.533278 -0.213509
C 4.675699 -0.590496 0.567320
C 5.293198 1.356269 -0.807604
C 7.050735 -0.069017 0.158585
C 6.044061 -0.879388 0.744951
C 6.647386 1.055479 -0.621330
C 8.512400 -0.343364 0.322731
C 8.950125 -1.548784 1.153636
H -4.641734 1.468587 0.123810
H -4.581091 0.452208 -1.331114
H -5.735283 -1.420747 -0.068950
H -5.806078 -0.398469 1.381577
H -3.217792 -0.218324 1.365616
H -3.170453 -1.247252 -0.081568
H -7.146057 0.272753 -1.326746
H -7.228070 1.283943 0.130658
H -2.053267 1.634900 0.088491
H -2.019113 0.614701 -1.364665
H -8.390620 -0.596360 1.371247
H -8.301538 -1.611514 -0.083216
H -0.609237 -1.092579 -0.131509
H -0.630638 -0.061052 1.316282
H -9.716321 0.076258 -1.344613
H -9.812499 1.084092 0.114296
H 0.544554 0.766569 -1.434270
H 0.539072 1.786546 0.022349
H -10.967098 -0.805880 1.343683
H -10.868628 -1.814483 -0.113119
H 1.978042 0.100668 1.224084
H 1.973410 -0.940273 -0.250569
H -12.423176 0.869301 0.094313
H -13.159275 -0.759129 0.078882
H -12.321321 -0.141469 -1.374019
H 3.923105 -1.233504 1.031886
H 4.971941 2.215395 -1.404113
H 6.322082 -1.749221 1.349667
H 7.431130 1.674883 -1.069648
H 8.552555 -2.490267 0.730713
H 8.583865 -1.470439 2.194368
H 10.049556 -1.594729 1.162381


