%chk=000194784.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194784

0 1
O 8.092670 0.409965 0.799655
O 6.678342 2.139884 0.713682
C -5.444440 -2.633421 0.522155
C -4.841534 -1.950095 1.760229
C -4.782330 -2.181733 -0.789668
C 4.628422 0.342613 -0.381392
C -4.942700 -0.454641 1.684671
C 3.836915 -0.571215 -1.326745
C -3.319509 -2.507978 -0.827339
C 6.126692 0.024814 -0.429192
C -3.871832 0.343720 1.727504
C -3.953919 1.841291 1.646676
C 2.368534 -0.277681 -1.255186
C -2.366558 -1.567558 -0.905766
C -2.670718 2.420788 1.121923
C 1.433842 -1.230910 -1.129586
C -0.939560 -1.881010 -0.955877
C 6.911463 0.999414 0.394214
C -2.518014 2.848665 -0.134185
C 0.004262 -0.931513 -1.081461
C -1.234439 3.421997 -0.660579
C -0.727694 2.631389 -1.866007
H -5.351691 -3.731095 0.632394
H -6.530073 -2.421653 0.468920
H -5.363023 -2.307203 2.672159
H -3.784571 -2.270107 1.874744
H -4.949760 -1.092067 -0.925298
H -5.288014 -2.670495 -1.648300
H 4.249666 0.230726 0.655158
H 4.461924 1.408691 -0.644047
H -5.954796 -0.067199 1.581887
H 4.179565 -0.429201 -2.374598
H 4.046029 -1.634236 -1.088614
H -3.083288 -3.570952 -0.783694
H 6.324998 -1.014797 -0.084969
H 6.504489 0.058806 -1.475951
H -2.861593 -0.058780 1.821972
H -4.817382 2.154783 1.023093
H -4.163374 2.252303 2.659439
H 2.105875 0.779114 -1.323733
H -2.625521 -0.504389 -0.929135
H -1.856913 2.451810 1.846202
H 1.705738 -2.286474 -1.057095
H -0.674064 -2.938202 -0.884952
H -3.328471 2.802507 -0.861659
H -0.270367 0.133189 -1.155068
H -0.451607 3.445726 0.124972
H -1.399819 4.482816 -0.945606
H -0.553519 1.572172 -1.602453
H -1.446871 2.644822 -2.692520
H 0.216534 3.039201 -2.241393
H 8.662105 1.018995 1.339620


%chk=000194784-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194784

0 1
O 8.723337 -0.100343 0.832358
O 6.998920 1.189588 1.699258
C -5.291093 -2.553037 0.466180
C -4.720280 -1.946925 1.779149
C -4.575003 -2.046740 -0.820051
C 5.055514 -0.037263 -0.093916
C -4.810797 -0.434134 1.817432
C 4.252569 -0.700061 -1.245435
C -3.110409 -2.413308 -0.881562
C 6.559575 -0.355673 -0.193034
C -3.753743 0.399590 1.996986
C -3.817576 1.919430 1.986517
C 2.781198 -0.359940 -1.200322
C -2.083890 -1.507656 -0.951622
C -2.856159 2.507574 0.963736
C 1.762722 -1.273364 -1.125965
C -0.672373 -1.855424 -1.007856
C 7.386637 0.335324 0.873223
C -3.217270 3.219328 -0.135443
C 0.348897 -0.933161 -1.075633
C -2.257967 3.767727 -1.173012
C -2.500902 3.162066 -2.580705
H -5.220044 -3.658417 0.519229
H -6.370061 -2.308307 0.387548
H -5.282888 -2.381449 2.632013
H -3.663795 -2.254448 1.898835
H -4.681605 -0.947554 -0.887114
H -5.103062 -2.479372 -1.696381
H 4.661440 -0.380987 0.880165
H 4.909496 1.059152 -0.115586
H -5.814055 -0.001899 1.665148
H 4.685086 -0.357252 -2.211272
H 4.384698 -1.799855 -1.212453
H -2.869963 -3.489479 -0.858062
H 6.747874 -1.444177 -0.123024
H 6.962276 -0.047123 -1.179220
H -2.752228 -0.039156 2.132880
H -4.851000 2.255106 1.777399
H -3.549283 2.304262 2.994368
H 2.529810 0.713026 -1.222318
H -2.332551 -0.434534 -0.957843
H -1.786306 2.308312 1.140107
H 2.015618 -2.345340 -1.101192
H -0.418173 -2.927186 -0.993059
H -4.287953 3.408685 -0.318592
H 0.091314 0.137733 -1.094534
H -1.215227 3.571506 -0.856399
H -2.368591 4.869994 -1.237609
H -2.348369 2.067243 -2.569442
H -3.535688 3.353831 -2.921139
H -1.811927 3.599768 -3.326536
H 9.243351 0.379911 1.533001


