%chk=000250514.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250514

0 1
O -2.004382 -1.200247 -1.311513
O 3.349162 -0.767169 0.316409
C -2.398101 -0.210481 0.787094
C -2.302725 1.314384 0.551580
C -1.427148 -1.125122 0.016797
C -2.081555 1.667718 -0.920813
C -1.238889 1.963144 1.445866
C -1.414315 -2.547145 0.606795
C -0.052738 -0.638248 -0.085316
C 2.468529 0.213283 -0.284450
C 1.087512 -0.259957 -0.183302
C 2.866698 0.403237 -1.752705
C 2.700707 1.462640 0.565565
H -2.296232 -0.413453 1.870602
H -3.424106 -0.535464 0.503928
H -3.297977 1.735859 0.856155
H -2.696560 1.030651 -1.573149
H -2.330221 2.711810 -1.125988
H -1.042396 1.503922 -1.227532
H -0.238764 1.562348 1.245413
H -1.194156 3.044733 1.280362
H -1.449564 1.800087 2.507136
H -0.769835 -3.221398 0.033576
H -2.423039 -2.977609 0.598300
H -1.052048 -2.553268 1.640758
H -1.444090 -1.724333 -1.913056
H 3.940092 0.616834 -1.834124
H 2.663244 -0.488240 -2.354489
H 2.324307 1.238170 -2.210702
H 2.069160 2.296261 0.243155
H 2.488065 1.256344 1.623807
H 3.750637 1.778108 0.512650
H 3.244728 -1.641601 -0.101709


%chk=000250514-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250514

0 1
O -1.977298 -1.254511 -1.372267
O 3.491220 -0.911397 0.287772
C -2.413556 -0.217239 0.766980
C -2.410611 1.324503 0.539374
C -1.405277 -1.128191 0.006361
C -2.334936 1.743378 -0.948141
C -1.334715 2.052768 1.384614
C -1.386653 -2.538369 0.659100
C -0.015844 -0.619597 -0.075198
C 2.587566 0.140945 -0.266732
C 1.173398 -0.295386 -0.165982
C 2.964452 0.416447 -1.744814
C 2.855615 1.369467 0.626583
H -2.284716 -0.406714 1.850747
H -3.405979 -0.619777 0.483162
H -3.396401 1.665474 0.924176
H -3.101253 1.226900 -1.551167
H -2.482862 2.836288 -1.042702
H -1.351988 1.490232 -1.382969
H -0.316243 1.763398 1.075064
H -1.429441 3.148995 1.267818
H -1.443519 1.816568 2.460564
H -0.768960 -3.237234 0.066134
H -2.418620 -2.928507 0.700947
H -0.974086 -2.497849 1.682426
H -1.315263 -1.731719 -1.937221
H 4.030848 0.696265 -1.796571
H 2.802798 -0.481086 -2.369384
H 2.355875 1.237952 -2.162204
H 2.253221 2.232113 0.294640
H 2.606537 1.137298 1.674677
H 3.926554 1.629927 0.568928
H 3.294136 -1.765548 -0.177616


