%chk=000229681.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229681

0 1
O -2.941826 -0.166150 -0.502902
O 0.583782 -0.608891 -0.814323
O 2.802047 0.944122 2.019554
O 1.090629 1.543418 -0.343113
C -5.268307 -0.149498 -0.288562
C -6.502044 0.249696 0.528176
C -3.978716 0.291148 0.403789
C -1.604742 0.141516 -0.048651
C -7.792945 -0.188861 -0.159013
C -0.741333 -0.209562 -1.261982
C 2.735340 -0.232232 -0.027523
C 1.438816 0.388930 -0.369232
C 3.428416 0.090924 1.156609
C 3.318661 -1.162965 -0.904937
C 4.689395 -0.462211 1.447241
C 4.565419 -1.720674 -0.625963
C 5.249004 -1.364400 0.545539
H -5.243117 -1.245582 -0.452127
H -5.310399 0.291799 -1.304636
H -6.515665 1.347117 0.681069
H -6.447569 -0.198756 1.539923
H -3.906443 1.386934 0.509796
H -3.836704 -0.192376 1.384857
H -1.522917 1.207697 0.227351
H -1.361306 -0.492597 0.822562
H -7.897358 0.266609 -1.150762
H -7.829338 -1.276135 -0.294376
H -8.672150 0.098624 0.428438
H -1.100253 -1.125063 -1.771305
H -0.651347 0.626105 -1.975613
H 2.776389 -1.443852 -1.812698
H 5.214058 -0.192046 2.358249
H 5.008479 -2.434973 -1.317045
H 6.227260 -1.801128 0.755213
H 3.360385 1.161212 2.810496


%chk=000229681-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229681

0 1
O -3.012800 -0.119944 -0.701439
O 0.664267 -0.570658 -0.875322
O 3.424193 1.764482 1.438487
O 1.007726 1.500294 0.143560
C -5.416726 0.040764 -0.421184
C -6.627305 -0.014608 0.539720
C -4.088224 -0.214094 0.296220
C -1.686638 -0.347962 -0.122196
C -7.967231 0.237040 -0.185036
C -0.693444 -0.116845 -1.267241
C 2.799151 -0.192026 0.126154
C 1.448728 0.369115 -0.161540
C 3.760992 0.518002 0.909412
C 3.166774 -1.467002 -0.389816
C 5.041053 -0.046837 1.148858
C 4.435787 -2.025909 -0.152744
C 5.377836 -1.307637 0.621880
H -5.538592 -0.709985 -1.225865
H -5.369603 1.031762 -0.912649
H -6.494994 0.737680 1.343990
H -6.658494 -1.004534 1.039490
H -3.922821 0.539029 1.099868
H -4.080267 -1.224353 0.766191
H -1.490774 0.357864 0.711780
H -1.597818 -1.389432 0.257930
H -7.975556 1.232612 -0.667009
H -8.137716 -0.518721 -0.974570
H -8.820416 0.193019 0.516435
H -0.960269 -0.738589 -2.135755
H -0.666236 0.949788 -1.546452
H 2.425376 -2.003933 -0.985955
H 5.771229 0.509328 1.751783
H 4.690678 -3.006840 -0.565210
H 6.371041 -1.727007 0.815925
H 4.184692 2.134036 1.956401


