%chk=000185713.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185713

0 1
O 5.950979 3.107998 0.478721
O 6.100176 1.833117 -1.384013
C -3.397600 -1.052321 0.266769
C -2.248214 -1.489679 -0.651308
C -4.411644 -0.177407 -0.482617
C -1.233553 -2.363733 0.098084
C -5.561755 0.259679 0.434716
C -0.087231 -2.805610 -0.821498
C -6.575225 1.134653 -0.314895
C 0.941824 -3.683636 -0.096422
C -7.726568 1.572696 0.601347
C 1.847152 -2.888415 0.855446
C -8.738243 2.444104 -0.139801
C 2.794103 -1.980374 0.135569
C 3.256816 -0.835730 0.663305
C 4.199230 0.024509 -0.045197
C 4.677191 1.168505 0.473561
C 5.624872 1.999693 -0.281725
C 6.884118 4.046996 -0.116149
H -3.905688 -1.942671 0.684674
H -2.994707 -0.498939 1.136881
H -2.651849 -2.041858 -1.521799
H -1.741168 -0.598375 -1.069199
H -4.814433 -0.729438 -1.353603
H -3.904137 0.713791 -0.899798
H -0.826267 -1.807323 0.964588
H -1.741213 -3.251741 0.521101
H -5.159197 0.812387 1.305397
H -6.069730 -0.631077 0.851880
H 0.413511 -1.915711 -1.251133
H -0.498341 -3.364241 -1.685261
H -6.978641 0.583870 -1.186173
H -6.068900 2.026118 -0.732374
H 0.420911 -4.476891 0.475856
H 1.560331 -4.217794 -0.844522
H -8.235620 0.681709 1.018146
H -7.324411 2.126117 1.472429
H 1.219560 -2.319699 1.574401
H 2.439170 -3.594105 1.479959
H -8.274033 3.355551 -0.533333
H -9.184621 1.912201 -0.987639
H -9.555729 2.751733 0.521677
H 3.101521 -2.318718 -0.857662
H 2.943425 -0.497211 1.653704
H 4.513830 -0.303764 -1.046300
H 4.401509 1.545389 1.460263
H 6.978488 4.814021 0.659037
H 6.460857 4.448567 -1.042218
H 7.835643 3.543658 -0.314273


%chk=000185713-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185713

0 1
O 5.045734 3.351998 0.481031
O 5.845835 1.809629 -1.085991
C -3.102889 -0.931880 0.232684
C -2.087610 -1.601673 -0.720207
C -4.224345 -0.166427 -0.505832
C -1.009602 -2.428917 0.017256
C -5.218263 0.534070 0.447689
C 0.036474 -3.045622 -0.939736
C -6.368175 1.258389 -0.288294
C 1.020158 -4.029120 -0.260669
C -7.350539 1.975506 0.665477
C 1.940812 -3.382474 0.817440
C -8.506884 2.680195 -0.076461
C 2.882602 -2.352096 0.246681
C 3.013848 -1.060536 0.685520
C 3.947779 -0.111262 0.102098
C 4.105542 1.185408 0.522583
C 5.076742 2.081810 -0.126630
C 5.981816 4.345378 -0.088467
H -3.558258 -1.706244 0.885457
H -2.565531 -0.233597 0.908231
H -2.629773 -2.261348 -1.429937
H -1.593753 -0.821792 -1.336809
H -4.778653 -0.872804 -1.158965
H -3.770627 0.589030 -1.181117
H -0.505252 -1.778328 0.760500
H -1.502673 -3.240106 0.593888
H -4.668411 1.264752 1.077450
H -5.646363 -0.216175 1.145585
H 0.607549 -2.230922 -1.429837
H -0.496134 -3.585770 -1.749417
H -6.928168 0.524468 -0.905299
H -5.942926 1.999026 -0.997943
H 0.447719 -4.850511 0.215688
H 1.660314 -4.499343 -1.035093
H -7.765505 1.237687 1.382658
H -6.792089 2.717358 1.272558
H 1.332245 -2.936444 1.625997
H 2.539594 -4.195324 1.281451
H -8.121221 3.442952 -0.779278
H -9.100728 1.954464 -0.663787
H -9.192682 3.186428 0.627830
H 3.511533 -2.684681 -0.595949
H 2.390887 -0.710862 1.522118
H 4.574189 -0.453513 -0.735410
H 3.521659 1.602770 1.349849
H 5.817658 5.258732 0.500730
H 5.759782 4.515647 -1.155929
H 7.023081 3.992677 0.007206


