%chk=000198785.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198785

0 1
O 2.930422 1.638161 1.243631
O 5.539315 0.447765 -0.329819
O 4.297937 -2.133724 0.014762
C 3.393321 1.540165 -0.138735
C 1.923450 1.425544 0.195437
C 4.141130 0.260042 -0.494926
C 1.293155 0.079641 0.163021
C 3.612021 -0.931374 0.350507
C 2.110419 -1.085873 0.201679
C -0.080001 -0.080006 0.072607
C -0.653545 -1.409416 0.012168
C -1.182734 0.904340 0.018263
C 1.547264 -2.355696 0.154739
C -2.122089 -1.289038 -0.086888
C -2.393638 0.126802 -0.080070
C 0.151697 -2.529617 0.053408
C -3.673633 0.675703 -0.154481
C -1.289876 2.269084 0.044320
C -3.175421 -2.158257 -0.173256
C -3.746536 2.107368 -0.128041
C -2.595543 2.857673 -0.031664
C -4.755310 -0.261704 -0.245400
C -4.501614 -1.615306 -0.253416
H 3.830606 2.462744 -0.529003
H 1.256609 2.288241 0.065556
H 4.054876 0.056626 -1.590629
H 3.871373 -0.800641 1.433950
H 2.198153 -3.233468 0.206557
H -0.272491 -3.531253 0.014598
H 5.779851 0.502445 0.623589
H 4.314681 -2.277794 -0.955507
H -0.417270 2.916889 0.125090
H -3.040765 -3.236649 -0.181820
H -4.722888 2.585077 -0.183423
H -2.657313 3.946425 -0.008787
H -5.773866 0.116779 -0.306472
H -5.329444 -2.322199 -0.321947


%chk=000198785-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198785

0 1
O 2.988133 1.698078 1.257109
O 5.655114 0.429556 -0.259074
O 4.371900 -2.194033 0.050224
C 3.438366 1.514382 -0.175995
C 1.975049 1.416496 0.132664
C 4.215908 0.241483 -0.465565
C 1.314056 0.082801 0.133325
C 3.653435 -0.953252 0.351040
C 2.134991 -1.090663 0.183300
C -0.090617 -0.067195 0.052596
C -0.667698 -1.392289 -0.008150
C -1.214220 0.915797 0.011683
C 1.550827 -2.374858 0.144808
C -2.137925 -1.262358 -0.102310
C -2.418396 0.139660 -0.088155
C 0.148233 -2.534115 0.036707
C -3.727530 0.682757 -0.146682
C -1.351397 2.310952 0.068021
C -3.206106 -2.161494 -0.187732
C -3.829596 2.114902 -0.100176
C -2.665180 2.890540 0.008347
C -4.810267 -0.259265 -0.237806
C -4.542667 -1.637879 -0.257592
H 3.840425 2.424339 -0.638399
H 1.354453 2.287253 -0.089347
H 4.135332 0.021410 -1.549183
H 3.873907 -0.770786 1.420479
H 2.210922 -3.245005 0.205484
H -0.288281 -3.537803 -0.000229
H 5.832923 0.479459 0.715140
H 4.453879 -2.291258 -0.933124
H -0.497290 2.986339 0.171144
H -3.051141 -3.245986 -0.199646
H -4.812737 2.598002 -0.142624
H -2.751575 3.982024 0.052996
H -5.844451 0.100904 -0.288534
H -5.378472 -2.343396 -0.325146


