%chk=000245359.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245359

0 1
O 1.047483 0.681406 -1.086939
O 2.288563 0.309210 0.833923
O 0.950679 1.182530 2.407121
C 2.275236 0.055045 -0.607607
C 0.233890 1.131962 0.013232
C 2.247385 -1.447267 -0.880520
C 3.438238 0.808520 -1.215984
C 1.115200 0.912036 1.253271
C -1.071097 0.381212 0.059607
C 1.350754 -2.221433 0.075869
C -1.527333 -0.291545 -1.081754
C -1.846183 0.395367 1.227996
C -2.757744 -0.953228 -1.052023
C -3.075835 -0.267213 1.249855
C -3.532945 -0.941036 0.111984
H 0.066143 2.219809 -0.179778
H 3.281554 -1.846767 -0.825853
H 1.907759 -1.601287 -1.927397
H 4.375759 0.583208 -0.688518
H 3.570225 0.565377 -2.277622
H 3.285710 1.895795 -1.152523
H 1.650480 -2.062859 1.121582
H 0.299379 -1.917122 -0.015052
H 1.398701 -3.298467 -0.120890
H -0.912443 -0.294863 -1.984513
H -1.489119 0.914397 2.120838
H -3.113018 -1.476830 -1.938190
H -3.678539 -0.258546 2.157217
H -4.492281 -1.455511 0.133066


%chk=000245359-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245359

0 1
O 0.949042 0.146876 -1.038515
O 2.256176 -0.005011 0.930701
O 0.755449 0.870024 2.479988
C 2.340765 -0.076361 -0.571233
C 0.209025 0.843389 0.022418
C 2.785263 -1.482267 -0.986368
C 3.260964 1.050727 -1.046412
C 1.043023 0.593977 1.307815
C -1.230456 0.346275 0.108014
C 1.942159 -2.618776 -0.377326
C -1.719009 -0.611916 -0.810588
C -2.093711 0.874771 1.100266
C -3.063221 -1.042523 -0.734794
C -3.434384 0.438165 1.174171
C -3.924564 -0.520202 0.256378
H 0.213729 1.939257 -0.165840
H 3.848886 -1.597687 -0.704553
H 2.738314 -1.516461 -2.091890
H 4.264424 0.938498 -0.602108
H 3.349775 1.018303 -2.145652
H 2.859146 2.037303 -0.757287
H 2.020008 -2.622211 0.723220
H 0.877954 -2.511314 -0.648169
H 2.295024 -3.596784 -0.749540
H -1.046143 -1.004727 -1.577908
H -1.714428 1.603885 1.824417
H -3.436020 -1.783324 -1.451064
H -4.094320 0.845072 1.948230
H -4.966268 -0.855057 0.314029


