%chk=000189473.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189473

0 1
O 1.875372 1.217394 -0.201040
O -2.820155 -3.588425 0.203665
C 0.964246 -1.050593 -0.063775
C 0.820277 0.415086 0.454113
C -0.235523 -1.936712 0.320138
C -2.752126 -2.226787 -0.307840
C -1.308863 -1.951921 -0.781321
C 2.311903 -1.624478 0.406486
C -2.950892 1.124935 -0.082871
C -3.249804 -1.320167 0.839760
C -3.890861 0.023515 0.470013
C -0.454510 0.984912 -0.110071
C 0.998712 0.595212 1.957231
C -3.552112 2.542565 0.143646
C -1.601867 1.001606 0.573934
C 3.423902 -0.672299 0.070818
C -3.713616 -2.282756 -1.495936
C 3.145094 0.682958 -0.210820
C -2.605430 3.621331 -0.397130
C -4.927070 2.675566 -0.523827
C 4.756442 -1.094106 0.011451
C 4.156322 1.593535 -0.559022
C 5.775149 -0.197832 -0.326393
C 5.472605 1.138265 -0.615979
H 1.013766 -0.985380 -1.184244
H -0.674666 -1.585938 1.277566
H 0.107464 -2.971867 0.509673
H -1.310585 -0.989659 -1.331450
H -1.038089 -2.718747 -1.535439
H 2.488199 -2.606705 -0.077404
H 2.300641 -1.823709 1.497208
H -2.844853 0.967494 -1.184967
H -2.419694 -1.160506 1.558179
H -4.008709 -1.910601 1.401968
H -4.703835 -0.144151 -0.263510
H -4.392634 0.408143 1.383194
H -0.385565 1.269153 -1.161094
H 0.798208 1.635118 2.248250
H 0.336016 -0.056917 2.533233
H 2.030140 0.381304 2.267715
H -3.674305 2.700772 1.243619
H -1.636167 0.831025 1.651518
H -3.739578 -1.340837 -2.049598
H -3.428827 -3.086048 -2.188153
H -4.731808 -2.517136 -1.159408
H -2.122820 -3.762813 0.854280
H -2.437455 3.513493 -1.473950
H -3.008987 4.625130 -0.227929
H -1.623298 3.578174 0.089431
H -4.880992 2.452667 -1.595211
H -5.314864 3.695986 -0.423370
H -5.667518 2.005180 -0.076734
H 5.002925 -2.132950 0.226875
H 3.896542 2.626428 -0.775778
H 6.805557 -0.541053 -0.367923
H 6.270396 1.829446 -0.885077


%chk=000189473-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189473

0 1
O 1.938893 1.241729 -0.229008
O -2.725405 -3.653100 0.332635
C 1.003783 -1.062501 -0.148780
C 0.855649 0.407335 0.411120
C -0.198243 -1.987105 0.203890
C -2.774737 -2.284406 -0.278899
C -1.360260 -1.947802 -0.832568
C 2.359320 -1.647024 0.311016
C -2.960543 1.216726 -0.080879
C -3.307044 -1.314852 0.823266
C -3.900832 0.076417 0.452463
C -0.440907 0.964272 -0.120791
C 1.023892 0.514983 1.938535
C -3.619999 2.624127 0.133182
C -1.597327 1.101175 0.573943
C 3.504023 -0.674110 0.059228
C -3.779339 -2.442366 -1.430586
C 3.239432 0.698060 -0.208769
C -2.722554 3.753968 -0.424254
C -5.029132 2.709256 -0.504577
C 4.853388 -1.104155 0.046710
C 4.290313 1.601249 -0.497982
C 5.912334 -0.212718 -0.228180
C 5.623356 1.145618 -0.508637
H 1.041334 -0.951538 -1.252766
H -0.568645 -1.718756 1.213824
H 0.174929 -3.027438 0.281979
H -1.405563 -0.954913 -1.309020
H -1.139801 -2.677159 -1.636939
H 2.551261 -2.593981 -0.229648
H 2.304129 -1.913948 1.387260
H -2.824001 1.088402 -1.176539
H -2.520861 -1.178514 1.593131
H -4.121700 -1.878564 1.321255
H -4.728113 -0.064657 -0.268309
H -4.373294 0.455320 1.383944
H -0.452220 1.089150 -1.213882
H 0.818805 1.548632 2.264020
H 0.339052 -0.163309 2.477597
H 2.055754 0.263790 2.235976
H -3.726477 2.774365 1.230346
H -1.593249 1.008479 1.670880
H -3.838774 -1.521761 -2.037926
H -3.467176 -3.274788 -2.084766
H -4.785053 -2.674882 -1.038767
H -2.121015 -3.619996 1.118502
H -2.607491 3.655472 -1.521713
H -3.169350 4.745086 -0.221702
H -1.713507 3.730770 0.022579
H -4.979098 2.492697 -1.589748
H -5.444084 3.727409 -0.386308
H -5.743627 2.002382 -0.047905
H 5.069887 -2.161397 0.247726
H 4.039937 2.646482 -0.705084
H 6.947451 -0.570272 -0.231862
H 6.434299 1.847959 -0.731511


