%chk=000182295.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182295

0 1
O 4.873147 1.012988 1.253728
O -0.746621 -3.149643 -0.058316
O -3.276621 2.653174 -0.018101
C 1.114999 0.578591 -0.515675
C 1.822564 -0.603127 0.218340
C 3.378156 -0.573809 0.214391
C 1.661825 1.901791 0.074058
C 1.282942 -1.943105 -0.292888
C -0.393256 0.465501 -0.256202
C 3.175897 2.019617 -0.059460
C 3.897368 0.842864 0.558451
C 1.280008 0.559055 -2.042996
C 4.012883 -0.941099 -1.134033
C 3.895381 -1.536582 1.297855
C -0.996837 -0.797653 -0.082736
C -0.216141 -2.057755 -0.130103
C -1.197145 1.607584 -0.237600
C -2.384125 -0.903096 0.129713
C -3.202294 0.223385 0.168544
C -2.577082 1.475296 -0.024091
C -4.694542 0.131583 0.400254
C -4.996643 -0.469443 1.776634
C -5.373292 -0.661666 -0.720918
H 1.520255 -0.512118 1.299348
H 1.372031 1.981204 1.142050
H 1.184450 2.768864 -0.426837
H 1.772111 -2.790330 0.234761
H 1.534796 -2.095470 -1.363422
H 3.529779 2.959933 0.415772
H 3.474384 2.104516 -1.124865
H 0.785482 -0.309449 -2.494233
H 0.842291 1.452946 -2.502546
H 2.340603 0.519459 -2.333609
H 5.105228 -0.836531 -1.102078
H 3.635471 -0.309696 -1.952328
H 3.805149 -1.983432 -1.402113
H 3.469168 -1.313966 2.282596
H 4.986606 -1.449129 1.408583
H 3.667646 -2.580221 1.060500
H -0.787571 2.605274 -0.389949
H -2.816922 -1.902433 0.263258
H -5.116229 1.180736 0.383044
H -4.662579 -1.511898 1.847131
H -6.070826 -0.459747 1.990436
H -4.490154 0.083753 2.575931
H -5.136180 -0.245885 -1.706927
H -6.462841 -0.660232 -0.609042
H -5.050809 -1.710175 -0.729657
H -4.258609 2.492978 0.140945


%chk=000182295-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182295

0 1
O 4.899457 1.052475 1.354953
O -0.792676 -3.190348 -0.101405
O -3.289042 2.750587 0.097283
C 1.124264 0.607975 -0.563045
C 1.841160 -0.585317 0.179239
C 3.421063 -0.574703 0.246178
C 1.708871 1.944486 -0.020692
C 1.283926 -1.941300 -0.308132
C -0.386357 0.495382 -0.247934
C 3.249768 2.015600 -0.141017
C 3.935124 0.853609 0.567802
C 1.242628 0.582245 -2.120853
C 4.126231 -1.001051 -1.083726
C 3.898396 -1.541381 1.363512
C -1.011121 -0.784773 -0.101392
C -0.232835 -2.051938 -0.164376
C -1.207593 1.636706 -0.173458
C -2.410642 -0.869663 0.113014
C -3.242419 0.261992 0.190559
C -2.601055 1.529108 0.042484
C -4.749742 0.112926 0.425727
C -5.044714 -0.553245 1.796509
C -5.429212 -0.663227 -0.734147
H 1.522626 -0.473397 1.240183
H 1.420796 2.064314 1.042511
H 1.279402 2.804020 -0.568615
H 1.723695 -2.790542 0.242766
H 1.529487 -2.107535 -1.376067
H 3.637170 2.955746 0.288259
H 3.543561 2.001979 -1.210054
H 0.880765 -0.368643 -2.548652
H 0.618802 1.389132 -2.546442
H 2.276664 0.739556 -2.469549
H 5.221198 -0.997716 -0.934960
H 3.896168 -0.340073 -1.934972
H 3.831108 -2.028753 -1.359906
H 3.369949 -1.348289 2.314778
H 4.975094 -1.395093 1.550635
H 3.731926 -2.595053 1.079111
H -0.801504 2.646164 -0.275840
H -2.828854 -1.877704 0.217584
H -5.229316 1.118288 0.455255
H -4.631988 -1.577648 1.828904
H -6.134503 -0.620571 1.969764
H -4.592972 0.018383 2.626820
H -5.252246 -0.169799 -1.706515
H -6.520270 -0.731999 -0.569704
H -5.030725 -1.691587 -0.800749
H -4.256214 2.604075 0.253971


