%chk=000180036.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180036

0 1
O 0.251718 0.115891 -1.158385
O 0.248541 0.158826 1.154763
O 0.794101 -1.789529 0.034708
C 2.405178 0.050780 0.002749
C 3.907545 0.474019 -0.003045
C 1.635585 0.551476 -1.243041
C 1.632177 0.597383 1.226945
C 2.214406 -1.484907 0.031030
C -0.045721 -0.637572 0.012165
C 4.612056 -0.054981 1.260480
C 4.615477 -0.101414 -1.244165
C 4.025639 2.009628 -0.031352
C -1.496830 -1.081727 0.018344
C -2.445143 0.121441 -0.003707
C -3.908919 -0.328146 0.002486
C -4.858116 0.883986 -0.019626
C -6.240660 0.475090 -0.013955
C -7.397286 0.136626 -0.009269
H 1.584560 1.650733 -1.310023
H 2.010598 0.123021 -2.187287
H 2.004594 0.204372 2.187496
H 1.580981 1.698367 1.252861
H 2.611499 -1.989156 -0.865512
H 2.608967 -1.955463 0.946802
H 4.583228 -1.147706 1.323357
H 4.167137 0.341480 2.178968
H 5.669657 0.234826 1.270251
H 4.173189 0.260834 -2.177927
H 5.673153 0.187754 -1.261701
H 4.586627 -1.195715 -1.266659
H 3.560970 2.476430 0.843224
H 5.076874 2.321944 -0.035788
H 3.563240 2.443683 -0.923813
H -1.667480 -1.740111 -0.860117
H -1.669420 -1.709060 0.918869
H -2.230215 0.741321 -0.899045
H -2.232195 0.772180 0.869948
H -4.116982 -0.947954 0.896937
H -4.115023 -0.978658 -0.870355
H -4.652912 1.511559 -0.918253
H -4.654778 1.542487 0.857025
H -8.387416 -0.151538 -0.005282


%chk=000180036-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180036

0 1
O 0.225288 0.121641 -1.209729
O 0.211365 0.178629 1.181547
O 0.767424 -1.844916 0.036930
C 2.411203 0.040069 0.001246
C 3.943204 0.466431 0.000398
C 1.654009 0.547372 -1.259567
C 1.640586 0.601925 1.230350
C 2.220426 -1.504093 0.033324
C -0.061200 -0.641825 0.003122
C 4.672389 -0.057920 1.272892
C 4.684049 -0.104980 -1.244745
C 4.091759 2.016448 -0.027608
C -1.523031 -1.061892 0.005560
C -2.500666 0.131670 -0.015006
C -3.972023 -0.333937 -0.002347
C -4.954642 0.871316 -0.013988
C -6.373709 0.472426 0.000769
C -7.559090 0.129416 0.013697
H 1.659325 1.650486 -1.321561
H 2.081944 0.125902 -2.186782
H 2.056260 0.219807 2.179871
H 1.648163 1.706578 1.245106
H 2.661323 -1.986943 -0.857121
H 2.656661 -1.948960 0.945421
H 4.656139 -1.160193 1.342011
H 4.238491 0.351876 2.202474
H 5.732737 0.253571 1.239838
H 4.261881 0.272354 -2.193183
H 5.745052 0.204142 -1.211316
H 4.664657 -1.208925 -1.274540
H 3.640821 2.496889 0.858785
H 5.165343 2.280264 -0.032719
H 3.639535 2.464514 -0.930089
H -1.677690 -1.708798 -0.876425
H -1.682203 -1.679771 0.907346
H -2.303914 0.743984 -0.915736
H -2.299824 0.776373 0.861887
H -4.169751 -0.950953 0.895752
H -4.178165 -0.975635 -0.881029
H -4.757754 1.490989 -0.911734
H -4.746855 1.516354 0.863215
H -8.590915 -0.169187 0.024786


