%chk=000140479.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000140479

0 1
C 0.507082 -0.369454 0.004536
C -0.556177 0.458720 0.825180
C 0.228190 -0.246985 -1.494914
C 0.590580 -1.845701 0.434655
C 1.919481 0.139305 0.372867
C -1.975892 -0.080569 0.897432
C -0.609017 1.928451 0.436035
C -0.284140 -1.322525 -2.239478
C 1.494831 -2.679861 -0.258246
C 2.924664 0.325566 -0.586266
C 0.480721 0.963746 -2.164878
C -0.114497 -2.387074 1.513510
C 2.248337 0.323617 1.728872
C -2.625575 0.007149 2.146950
C 0.245397 2.840893 1.076983
C -2.682593 -0.608506 -0.187766
C -1.519401 2.410800 -0.518178
C -0.531457 -1.193398 -3.609440
C 1.657665 -4.016358 0.099034
C 4.205261 0.741894 -0.205688
C 0.229436 1.094332 -3.532344
C 0.047241 -3.732945 1.871485
C 3.525628 0.735701 2.109294
C -3.933744 -0.449086 2.304439
C 0.195969 4.201753 0.763634
C -3.993696 -1.072579 -0.026464
C -1.570352 3.772736 -0.826369
C -0.276021 0.014739 -4.262322
C 0.927532 -4.552704 1.167203
C 4.509781 0.956160 1.139966
C -4.622495 -0.999555 1.217191
C -0.712718 4.673206 -0.187934
H -0.167501 0.423213 1.890088
H -0.508681 -2.275918 -1.756250
H 2.079864 -2.273138 -1.084569
H 2.732429 0.138490 -1.643383
H 0.881500 1.819668 -1.615482
H -0.805462 -1.786597 2.101838
H 1.495871 0.131250 2.496944
H -2.107639 0.444242 2.999285
H 0.961462 2.495816 1.821593
H -2.229957 -0.653089 -1.176695
H -2.191511 1.723802 -1.032572
H -0.925168 -2.041409 -4.167311
H 2.357419 -4.643910 -0.450200
H 4.968804 0.893581 -0.967279
H 0.429031 2.042635 -4.028804
H -0.521609 -4.134874 2.708497
H 3.758189 0.878338 3.163192
H -4.421433 -0.374719 3.274956
H 0.867918 4.895845 1.265393
H -4.523812 -1.489626 -0.881436
H -2.283151 4.131650 -1.566849
H -0.468714 0.114856 -5.327923
H 1.051623 -5.596568 1.445321
H 5.504853 1.282056 1.433435
H -5.640336 -1.361439 1.341045
H -0.753610 5.732882 -0.428415


%chk=000140479-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000140479

0 1
C 0.523246 -0.398190 -0.040957
C -0.574291 0.447002 0.798023
C 0.249439 -0.303362 -1.568738
C 0.603806 -1.885894 0.436771
C 1.949249 0.152344 0.339415
C -2.016488 -0.092901 0.856821
C -0.612609 1.958346 0.466606
C -0.202554 -1.418168 -2.325012
C 1.570735 -2.729655 -0.180727
C 2.928374 0.527899 -0.612386
C 0.403969 0.931229 -2.259585
C -0.138594 -2.425001 1.515535
C 2.339295 0.151401 1.708581
C -2.712852 0.072526 2.085976
C 0.320817 2.845425 1.066642
C -2.725349 -0.661317 -0.230964
C -1.602626 2.513706 -0.386468
C -0.486613 -1.310723 -3.704742
C 1.770017 -4.057792 0.242012
C 4.224406 0.933184 -0.214008
C 0.116600 1.044975 -3.637196
C 0.061550 -3.757916 1.948930
C 3.625735 0.558767 2.113184
C -4.057237 -0.328003 2.234109
C 0.286882 4.232593 0.800311
C -4.071782 -1.069479 -0.086751
C -1.640928 3.899696 -0.654065
C -0.329979 -0.075672 -4.372281
C 1.011779 -4.584664 1.315026
C 4.580218 0.963937 1.150339
C -4.746058 -0.908724 1.143467
C -0.693039 4.768214 -0.066187
H -0.201602 0.391841 1.838585
H -0.341654 -2.385330 -1.833049
H 2.185220 -2.331676 -0.996035
H 2.695973 0.495915 -1.679957
H 0.750675 1.817594 -1.722835
H -0.896025 -1.826466 2.024969
H 1.642362 -0.209173 2.473949
H -2.191507 0.531020 2.936662
H 1.086832 2.450558 1.741387
H -2.235830 -0.788024 -1.198258
H -2.354942 1.861417 -0.839922
H -0.833109 -2.194086 -4.253299
H 2.522707 -4.678095 -0.257823
H 4.955550 1.219461 -0.978871
H 0.244461 2.014166 -4.132564
H -0.533872 -4.144835 2.783892
H 3.888645 0.543953 3.177153
H -4.565493 -0.187648 3.195006
H 1.021665 4.892772 1.275318
H -4.593337 -1.511753 -0.943567
H -2.415771 4.300501 -1.317699
H -0.549904 0.011404 -5.442290
H 1.165068 -5.616334 1.651060
H 5.583505 1.278646 1.458313
H -5.789421 -1.225716 1.251422
H -0.724914 5.844611 -0.269829


