%chk=000238510.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238510

0 1
O 2.865644 1.707725 -1.875232
O 0.172878 -0.544779 -0.206264
O -3.164994 1.082748 -0.031381
O -1.058915 1.235050 2.115246
O -1.902233 2.895914 -0.595213
C 3.631077 0.039043 1.089922
C 3.128090 -0.123509 -0.360531
C 4.685043 1.147071 1.180901
C 4.198120 -1.293614 1.590882
C 2.467561 1.111778 -0.904669
C 1.231449 1.632914 -0.166711
C 0.184305 0.609620 0.120461
C -1.003665 1.211004 0.922156
C -2.062331 1.862506 0.005109
C -4.290377 1.503373 -0.885738
C -3.963417 1.225969 -2.334238
H 2.762916 0.314361 1.740164
H 2.414332 -0.977994 -0.421027
H 3.975246 -0.405434 -1.022959
H 4.297427 2.115659 0.848973
H 5.044024 1.271675 2.208868
H 5.561343 0.924928 0.559306
H 4.544738 -1.211567 2.627632
H 3.446211 -2.090443 1.561598
H 5.052604 -1.626535 0.990770
H 0.784298 2.468915 -0.769123
H 1.568296 2.134933 0.770208
H -5.090241 0.855640 -0.479236
H -4.498622 2.568255 -0.682919
H -4.842863 1.364291 -2.976669
H -3.177459 1.899093 -2.709399
H -3.607084 0.196911 -2.481787


%chk=000238510-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238510

0 1
O 4.447474 2.148132 -1.414430
O 0.491881 1.330793 -1.906939
O -2.276936 1.060857 0.208091
O -0.020555 2.901575 1.225204
O -2.285575 2.948363 -1.186941
C 2.797700 0.014179 0.949443
C 3.225252 0.227607 -0.535067
C 3.856993 0.577257 1.925693
C 2.545707 -1.489720 1.206993
C 3.381802 1.687515 -0.936356
C 2.183522 2.646210 -0.697830
C 0.804860 2.071593 -0.937323
C -0.290329 2.414069 0.102127
C -1.727493 2.172115 -0.379583
C -3.685534 0.701512 -0.198129
C -3.667948 -0.140754 -1.474298
H 1.841532 0.550350 1.128473
H 2.465123 -0.230241 -1.200025
H 4.190098 -0.275793 -0.726344
H 4.034531 1.657963 1.771347
H 3.536910 0.434654 2.973658
H 4.824547 0.058124 1.789877
H 2.225165 -1.659497 2.251082
H 1.760358 -1.889435 0.539065
H 3.468946 -2.075769 1.037561
H 2.328577 3.505831 -1.379954
H 2.235321 3.042099 0.335627
H -4.059979 0.143270 0.673478
H -4.254872 1.637982 -0.329024
H -4.698021 -0.462720 -1.714619
H -3.280051 0.439434 -2.327735
H -3.045606 -1.042051 -1.344019


