%chk=000198049.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198049

0 1
O 4.356253 0.276822 -1.696057
O -4.404966 2.667297 -0.388728
O -5.773199 0.520835 0.493941
C 2.707155 0.372980 0.160569
C 1.995995 -0.947838 -0.278505
C 0.534997 -0.940747 0.183091
C 4.186776 0.052349 -0.277052
C -0.178144 0.228253 -0.559026
C 2.035849 1.545774 -0.566560
C 2.944381 -2.060331 0.201390
C 0.526638 1.573353 -0.270440
C 4.360175 -1.467830 0.027181
C -0.196873 -2.253652 -0.125019
C 2.685151 0.603543 1.677204
C -1.656172 0.255279 -0.228674
C -1.615542 -2.205720 0.453858
C -2.324255 -0.898561 0.213786
C 5.206962 0.885760 0.330588
C -2.385355 1.443134 -0.432376
C -3.711572 -0.866049 0.475213
C -3.751255 1.477356 -0.176081
C -4.420582 0.310926 0.284960
C 6.059414 1.579154 0.823833
C -6.559085 -0.611661 0.933267
H 1.990595 -0.984102 -1.399861
H 0.489252 -0.755377 1.283934
H -0.106303 0.035607 -1.663028
H 2.219427 1.477394 -1.656244
H 2.497494 2.503505 -0.259038
H 2.817412 -2.986364 -0.380180
H 2.751902 -2.325529 1.254713
H 0.358310 1.857381 0.786936
H 0.057362 2.374946 -0.874972
H 4.971560 -1.622325 0.931107
H 4.911516 -1.951428 -0.796807
H 0.353530 -3.113148 0.299707
H -0.236420 -2.427457 -1.217146
H 3.205304 -0.189487 2.224311
H 3.166732 1.553265 1.938922
H 1.657537 0.642729 2.059927
H -1.576151 -2.386959 1.549991
H -2.211142 -3.041338 0.032121
H 3.732312 -0.282355 -2.203632
H -1.898113 2.349829 -0.794112
H -4.211340 -1.765455 0.823058
H 6.790701 2.173933 1.245995
H -5.375405 2.577924 -0.180432
H -6.208624 -0.958673 1.909716
H -6.530441 -1.406652 0.182348
H -7.562655 -0.173085 1.006704


%chk=000198049-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198049

0 1
O 4.304693 0.149703 -1.825303
O -4.530257 2.700524 -0.384566
O -5.883426 0.516204 0.405708
C 2.760483 0.367437 0.181754
C 2.014849 -0.942793 -0.227884
C 0.536946 -0.939443 0.202159
C 4.217941 0.027096 -0.340060
C -0.168344 0.271623 -0.485690
C 2.074257 1.576714 -0.489904
C 2.959176 -2.078749 0.242738
C 0.554401 1.613389 -0.166802
C 4.399201 -1.481680 0.081633
C -0.217073 -2.239559 -0.147162
C 2.815182 0.569685 1.720360
C -1.678392 0.289015 -0.193757
C -1.630835 -2.208107 0.468953
C -2.362045 -0.890008 0.219880
C 5.273241 0.914957 0.164263
C -2.430052 1.479097 -0.392153
C -3.766701 -0.852842 0.431786
C -3.815403 1.511802 -0.182155
C -4.491306 0.333382 0.236568
C 6.157075 1.657554 0.590319
C -6.668094 -0.641071 0.832463
H 1.991952 -0.968525 -1.345451
H 0.480525 -0.807660 1.304120
H -0.051583 0.105757 -1.583330
H 2.223194 1.514926 -1.585413
H 2.547326 2.521863 -0.159934
H 2.826440 -3.003661 -0.345435
H 2.757045 -2.334569 1.299688
H 0.387651 1.871767 0.897321
H 0.103014 2.432210 -0.756975
H 4.969940 -1.552766 1.022837
H 4.994672 -1.992464 -0.695369
H 0.332658 -3.122727 0.230653
H -0.281867 -2.341442 -1.250347
H 3.281516 -0.281836 2.246594
H 3.410132 1.469968 1.953581
H 1.808691 0.713999 2.146960
H -1.542612 -2.371841 1.564315
H -2.237398 -3.050060 0.081332
H 3.671439 -0.504023 -2.221232
H -1.951111 2.406741 -0.716109
H -4.277235 -1.769628 0.748228
H 6.932757 2.304131 0.955266
H -5.487686 2.524502 -0.184260
H -6.327561 -1.008546 1.819717
H -6.604423 -1.458890 0.089002
H -7.705899 -0.283950 0.905495


