%chk=000193157.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193157

0 1
O -0.512059 -1.905277 0.218547
O 4.405366 0.580451 -0.131914
O -0.361530 2.203424 -0.322519
O -6.447946 0.013687 -0.006470
O 7.213876 1.249255 1.171560
O -5.587570 2.059316 -0.280203
C 0.819150 0.154709 -0.059256
C -1.666271 0.239053 -0.058471
C 0.715566 -1.233540 0.124259
C -1.662144 -1.154702 0.125125
C -0.402969 1.003143 -0.164871
C 2.092539 0.721851 -0.140393
C -2.907570 0.893583 -0.138902
C 3.221122 -0.113709 -0.035299
C 1.832465 -2.072316 0.229524
C -2.849140 -1.909950 0.230205
C -4.094606 0.160480 -0.036805
C 3.102113 -1.503015 0.148316
C -4.060019 -1.243076 0.148019
C 5.656520 -0.167797 -0.046345
C -5.375497 0.878604 -0.125480
C 6.715353 0.934961 -0.129899
H 2.211321 1.800706 -0.284113
H -2.931922 1.984768 -0.282518
H 1.698446 -3.144800 0.371905
H -2.792621 -2.988603 0.372153
H 3.980553 -2.139775 0.228993
H -5.006051 -1.792710 0.224917
H 5.698718 -0.704783 0.917877
H 5.704156 -0.872969 -0.892124
H 6.306420 1.845038 -0.612862
H 7.620773 0.595061 -0.669697
H -7.319509 0.490989 -0.065231
H 6.524466 1.710943 1.697672


%chk=000193157-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193157

0 1
O -0.512100 -1.965555 0.152450
O 4.482600 0.600060 -0.104987
O -0.361509 2.226364 -0.207605
O -6.539922 0.074162 0.020897
O 6.834058 1.693514 1.156597
O -5.534542 2.161185 -0.162077
C 0.821028 0.120591 -0.036271
C -1.683579 0.205250 -0.024495
C 0.727109 -1.293451 0.086069
C -1.689602 -1.214519 0.096989
C -0.405130 0.961262 -0.099050
C 2.103304 0.712747 -0.096071
C -2.928418 0.878107 -0.072373
C 3.261890 -0.085157 -0.034894
C 1.878448 -2.100719 0.146517
C -2.896489 -1.948779 0.168612
C -4.138986 0.160461 -0.002341
C 3.149586 -1.500853 0.085948
C -4.116297 -1.261868 0.118856
C 5.736343 -0.180496 -0.028075
C -5.416917 0.917655 -0.057623
C 6.859035 0.855546 -0.041798
H 2.175903 1.800242 -0.191397
H -2.933347 1.969325 -0.164846
H 1.768022 -3.184653 0.239658
H -2.851106 -3.037267 0.261209
H 4.038944 -2.134966 0.132699
H -5.063510 -1.804543 0.172011
H 5.758173 -0.758183 0.917373
H 5.810239 -0.868830 -0.895073
H 6.787278 1.466307 -0.965606
H 7.836500 0.344840 -0.025782
H -7.361101 0.633551 -0.021266
H 5.945596 2.131671 1.201444


