%chk=000251070.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251070

0 1
O 1.452877 -1.729981 -0.948597
O -2.131757 -1.356306 -0.438271
O 0.885676 -0.960118 1.105305
O -2.247281 0.829494 0.135309
C 0.352679 1.310392 -1.124922
C 0.519728 2.087667 0.185779
C -0.221950 -0.106756 -0.934678
C 1.217440 3.433051 -0.050965
C 0.722439 -0.941461 -0.087817
C -1.614185 -0.082913 -0.328070
C 1.370988 4.217001 1.250378
C 2.447997 -2.603300 -0.348147
C -3.455416 -1.576908 0.120243
H 1.327191 1.227899 -1.649012
H -0.316577 1.875377 -1.806903
H -0.476855 2.253316 0.650835
H 1.088750 1.489255 0.925840
H -0.305515 -0.594601 -1.951545
H 0.640981 4.034511 -0.781309
H 2.213382 3.270037 -0.507205
H 1.869133 5.177437 1.079319
H 0.398035 4.428124 1.710312
H 1.964646 3.663922 1.987686
H 2.854548 -3.132177 -1.216704
H 1.961189 -3.285681 0.356161
H 3.207174 -1.998844 0.157612
H -3.711705 -2.571663 -0.259557
H -4.149413 -0.808567 -0.235950
H -3.383299 -1.562206 1.212474


%chk=000251070-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000251070

0 1
O 1.586317 -1.634032 -0.980843
O -2.193773 -1.417824 -0.391206
O 0.574207 -1.191083 1.070663
O -2.384153 0.890638 -0.172141
C 0.323552 1.304365 -1.144461
C 0.630784 2.019648 0.189690
C -0.274897 -0.128697 -1.016817
C 1.173503 3.449196 -0.038155
C 0.622221 -1.030419 -0.167058
C -1.705607 -0.115686 -0.469226
C 1.494856 4.179678 1.283248
C 2.573728 -2.487051 -0.274398
C -3.565359 -1.562817 0.154065
H 1.246913 1.231903 -1.751545
H -0.401236 1.911791 -1.719919
H -0.289674 2.070687 0.800336
H 1.370486 1.438684 0.775534
H -0.318807 -0.581023 -2.025599
H 0.426677 4.034877 -0.612120
H 2.086069 3.403108 -0.668249
H 1.875246 5.201430 1.099708
H 0.591924 4.262287 1.916858
H 2.260978 3.631644 1.863699
H 3.243173 -2.854077 -1.064610
H 2.059773 -3.320715 0.232553
H 3.125959 -1.893777 0.473766
H -3.762055 -2.643468 0.133461
H -4.286202 -1.012362 -0.473624
H -3.603702 -1.170904 1.183990


