%chk=000275019.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275019

0 1
O -0.415402 0.881031 -1.843765
O -1.079977 1.923428 1.541785
O -0.768865 3.099359 -0.332279
C 0.953777 0.214938 0.112174
C -0.434068 0.648475 -0.432086
C 1.392420 -1.197327 -0.361618
C -1.576616 -0.391438 -0.270238
C 2.044099 1.254483 -0.212340
C 2.725733 -1.564773 0.326209
C 3.833116 -0.527062 0.056888
C 3.364892 0.881945 0.472797
C -1.731295 -0.887237 1.177303
C -2.909222 0.189170 -0.786061
C -2.852270 -1.931840 1.272953
C -4.025541 -0.858584 -0.698863
C 1.500392 -1.327761 -1.882063
C -4.181442 -1.383255 0.735399
C -0.782573 2.017086 0.205387
C 5.121259 -0.906704 0.795771
H 0.849112 0.167504 1.230367
H 0.621180 -1.930246 -0.010227
H -1.303562 -1.259341 -0.926322
H 1.736983 2.266595 0.113683
H 2.193512 1.315751 -1.308213
H 3.057590 -2.560158 -0.022572
H 2.564736 -1.666191 1.415476
H 4.045290 -0.517409 -1.041555
H 4.141306 1.626901 0.217448
H 3.247901 0.932766 1.571898
H -0.784865 -1.322870 1.546559
H -1.956092 -0.031202 1.848192
H -3.192780 1.084330 -0.201076
H -2.780896 0.531421 -1.833187
H -2.974834 -2.250082 2.325181
H -2.568067 -2.840909 0.708808
H -3.808766 -1.698756 -1.386189
H -4.978917 -0.418698 -1.046699
H 0.579824 -0.987128 -2.379814
H 2.320680 -0.725776 -2.287980
H 1.676575 -2.365591 -2.180442
H -4.956143 -2.171233 0.768010
H -4.542474 -0.569274 1.393083
H 5.480448 -1.894726 0.488030
H 5.924272 -0.190292 0.591746
H 4.977177 -0.935568 1.881133
H 0.183046 1.629099 -2.077840
H -1.294256 2.807148 1.947953


%chk=000275019-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275019

0 1
O -0.323329 0.954685 -1.914206
O -0.792339 2.064930 1.562950
O -1.049989 3.097154 -0.488662
C 0.970662 0.229187 0.079512
C -0.420610 0.708051 -0.463499
C 1.398808 -1.201537 -0.383022
C -1.588506 -0.327062 -0.248549
C 2.086042 1.264656 -0.219383
C 2.721780 -1.570501 0.351084
C 3.871556 -0.562853 0.095523
C 3.412014 0.867746 0.471667
C -1.738739 -0.887448 1.189549
C -2.947476 0.231046 -0.746564
C -2.834786 -1.981365 1.238479
C -4.047510 -0.855320 -0.700762
C 1.532273 -1.393710 -1.914448
C -4.192265 -1.453026 0.718705
C -0.781584 2.063322 0.173812
C 5.147791 -0.964874 0.865002
H 0.863713 0.181913 1.183993
H 0.629041 -1.919503 -0.032335
H -1.321777 -1.172563 -0.917198
H 1.780817 2.270447 0.134396
H 2.229241 1.347184 -1.312708
H 3.040271 -2.586202 0.040357
H 2.534774 -1.614779 1.446198
H 4.107191 -0.571576 -0.989481
H 4.205652 1.597225 0.214259
H 3.278980 0.918187 1.574131
H -0.783487 -1.311410 1.550859
H -2.006069 -0.068224 1.884059
H -3.259962 1.082918 -0.104997
H -2.832952 0.618932 -1.775038
H -2.941676 -2.356170 2.275129
H -2.518930 -2.845316 0.616904
H -3.788590 -1.665650 -1.413737
H -5.012194 -0.429401 -1.038575
H 0.572250 -1.230265 -2.429467
H 2.253432 -0.689045 -2.363081
H 1.883705 -2.421218 -2.129997
H -4.945279 -2.264951 0.719002
H -4.565850 -0.667945 1.408733
H 5.494586 -1.973719 0.571697
H 5.973791 -0.253717 0.674321
H 4.959698 -0.977386 1.956551
H -0.581592 1.904304 -2.076294
H -1.036181 2.974850 1.887933


