%chk=000140217.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000140217

0 1
O 6.611467 -1.303820 0.834567
O -6.610622 -1.298239 -0.842071
C 0.396334 -0.232758 -0.661618
C -0.395212 -0.233272 0.657811
C 1.875610 -0.230934 -0.391209
C -1.874489 -0.230356 0.387395
C 4.640471 -0.222607 0.119370
C -4.639317 -0.220012 -0.123122
C 2.562858 -1.441385 -0.210723
C -2.562497 -1.440276 0.206215
C 2.578025 0.982173 -0.307369
C -2.576126 0.983243 0.304220
C 3.933522 -1.434916 0.046406
C -3.933155 -1.432812 -0.050931
C 3.950831 0.984895 -0.055470
C -3.948936 0.986968 0.052351
C 6.927404 0.948074 0.092727
C -6.925950 0.950855 -0.091387
C 6.110342 -0.288398 0.397050
C -6.109245 -0.284576 -0.400823
C 8.429679 0.698935 0.281156
C -8.428323 0.702812 -0.280400
C 9.250685 1.954130 0.007120
C -9.249240 1.956134 0.002329
H 0.105593 0.645655 -1.274557
H 0.111020 -1.115354 -1.272180
H -0.110357 -1.116680 1.267407
H -0.104020 0.644322 1.271708
H 2.027346 -2.387574 -0.268201
H -2.027561 -2.386827 0.263123
H 2.051131 1.925321 -0.438725
H -2.048629 1.925988 0.436059
H 4.473963 -2.375028 0.198487
H -4.474146 -2.372482 -0.203674
H 4.477074 1.937348 0.009115
H -4.474630 1.939758 -0.011769
H 6.726930 1.285089 -0.944765
H 6.599666 1.780325 0.748850
H -6.725034 1.283651 0.947394
H -6.598225 1.785696 -0.744202
H 8.755057 -0.127035 -0.383743
H 8.617348 0.331272 1.311430
H -8.753185 -0.127505 0.379342
H -8.616667 0.341834 -1.312894
H 9.112231 2.316418 -1.017733
H 10.321628 1.757927 0.140485
H 8.983999 2.772164 0.685623
H -9.110653 2.311368 1.029634
H -10.320208 1.760897 -0.132244
H -8.982588 2.778798 -0.670562


%chk=000140217-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000140217

0 1
O 6.772645 -1.478063 0.216385
O -6.772168 -1.475081 -0.222825
C 0.370303 -0.226457 -0.691813
C -0.369355 -0.229433 0.689863
C 1.880192 -0.243070 -0.527626
C -1.879256 -0.244833 0.525694
C 4.716048 -0.277987 -0.135793
C -4.715166 -0.277120 0.134064
C 2.579337 -1.469919 -0.364297
C -2.578885 -1.470760 0.357597
C 2.625361 0.964032 -0.492236
C -2.623971 0.962685 0.495174
C 3.972017 -1.489059 -0.171605
C -3.971596 -1.488607 0.165018
C 4.022272 0.951055 -0.299922
C -4.020902 0.951007 0.302929
C 7.016265 0.945300 0.088221
C -7.014810 0.947926 -0.086481
C 6.205016 -0.354999 0.067837
C -6.204184 -0.352814 -0.069660
C 8.525789 0.727348 0.304922
C -8.524300 0.731297 -0.304718
C 9.311219 2.055468 0.307002
C -9.309059 2.059808 -0.304328
H 0.051105 0.667951 -1.259121
H 0.036340 -1.110549 -1.267263
H -0.035645 -1.116190 1.261338
H -0.049858 0.662324 1.261164
H 2.021850 -2.414294 -0.398108
H -2.021743 -2.415465 0.387616
H 2.104222 1.920343 -0.623935
H -2.102464 1.918268 0.630647
H 4.519283 -2.429849 -0.049123
H -4.519249 -2.428697 0.038939
H 4.568055 1.900331 -0.282669
H -4.566335 1.900551 0.289466
H 6.842762 1.485326 -0.866486
H 6.608393 1.606578 0.881642
H -6.841605 1.484936 0.869978
H -6.606177 1.611440 -0.877643
H 8.910932 0.055094 -0.483966
H 8.681166 0.188222 1.257821
H -8.910353 0.057427 0.482346
H -8.679270 0.194428 -1.258957
H 9.195368 2.592919 -0.653717
H 10.390690 1.877914 0.463504
H 8.961743 2.729146 1.112765
H -9.193603 2.595082 0.657660
H -10.388514 1.883145 -0.461946
H -8.958704 2.735101 -1.108354


