%chk=000231162.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231162

0 1
O 2.971685 0.668876 0.415658
O 0.856815 2.572318 1.160058
O 2.071109 -1.910740 -0.532317
O -3.348469 0.402185 0.458753
O -3.023821 -1.701994 -0.300932
C -1.111961 -0.278447 0.172093
C 1.622086 0.352272 0.315619
C 0.649524 1.302741 0.693004
C 1.193869 -0.932873 -0.093355
C -0.723942 0.982234 0.618375
C -0.164446 -1.251822 -0.176893
C -2.553407 -0.648331 0.063244
C -4.800054 0.222698 0.388273
C -5.266778 0.374979 -1.043930
C 3.641969 0.728938 -0.878726
C 2.222115 3.032539 1.338046
C 3.072708 -2.316204 0.442793
H -1.465174 1.733522 0.905791
H -0.474787 -2.245262 -0.510649
H -5.138564 1.041430 1.049274
H -5.053873 -0.763248 0.816950
H -4.921158 -0.465506 -1.665275
H -4.877266 1.294556 -1.499602
H -6.360483 0.404766 -1.109354
H 4.680625 0.918542 -0.590848
H 3.536771 -0.226823 -1.405688
H 3.228688 1.550485 -1.468755
H 2.066133 3.991490 1.846114
H 2.787563 2.328543 1.959142
H 2.697041 3.160793 0.362035
H 2.578009 -2.863314 1.250428
H 3.623059 -1.449607 0.826258
H 3.714414 -2.976237 -0.150982


%chk=000231162-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231162

0 1
O 3.058141 0.753921 0.079908
O 1.065868 2.731283 0.723417
O 2.185859 -1.933822 -0.517038
O -3.342038 0.447964 0.433035
O -2.947989 -1.761113 -0.214030
C -1.067720 -0.241845 0.123122
C 1.692016 0.401698 0.123140
C 0.726119 1.391186 0.471959
C 1.257489 -0.926853 -0.163976
C -0.646711 1.065661 0.465751
C -0.111640 -1.243003 -0.180071
C -2.509420 -0.621188 0.084862
C -4.811495 0.182605 0.393314
C -5.364470 0.410455 -1.016644
C 3.661109 0.688711 -1.277386
C 2.070493 2.984858 1.780630
C 3.131099 -2.312403 0.559767
H -1.376637 1.839966 0.710815
H -0.435814 -2.258449 -0.424094
H -5.224000 0.899788 1.121132
H -4.990994 -0.853065 0.731544
H -4.946222 -0.325100 -1.723888
H -5.125278 1.427046 -1.373643
H -6.464477 0.295690 -1.009209
H 4.720189 0.953292 -1.138368
H 3.564753 -0.329163 -1.694114
H 3.168855 1.423396 -1.939972
H 2.198570 4.077762 1.793834
H 1.684409 2.640868 2.759650
H 3.023798 2.482820 1.547696
H 2.577245 -2.742349 1.415532
H 3.722376 -1.440204 0.891952
H 3.786518 -3.076909 0.115973


