%chk=000188637.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188637

0 1
O 3.147029 -1.023181 -0.215975
O -0.388424 -0.988064 -0.427426
O -1.202282 2.410304 -0.434453
C 2.737308 0.392424 -0.070681
C 1.860082 -1.645457 0.133856
C 0.947797 -0.973666 -0.961947
C 1.544908 0.451193 -1.070436
C 2.181968 0.401984 1.382091
C 1.551466 -1.004984 1.514023
C 3.941866 1.276065 -0.403041
C 1.991445 -3.139863 0.066464
C 3.569883 2.756279 -0.276268
C 5.144779 0.925052 0.478060
C -1.400276 -0.537891 -1.368057
C -2.644637 -0.328805 -0.544360
C -2.707039 0.695123 0.420787
C -3.761742 -1.147580 -0.759906
C -3.888952 0.891584 1.146892
C -1.508599 1.567330 0.691770
C -4.936856 -0.944588 -0.030949
C -5.001601 0.076144 0.921526
H 0.966968 -1.521070 -1.919510
H 1.885815 0.673799 -2.090506
H 0.806196 1.228827 -0.804015
H 1.453109 1.208138 1.541285
H 2.992962 0.547466 2.111968
H 2.006376 -1.580270 2.332333
H 0.464876 -0.966771 1.699865
H 4.225712 1.064387 -1.467507
H 2.384763 -3.464289 -0.906618
H 2.691594 -3.513858 0.825839
H 1.021717 -3.629056 0.224912
H 2.728617 3.020148 -0.927125
H 3.285820 3.017498 0.749216
H 4.414644 3.397010 -0.552591
H 5.316329 -0.162091 0.471679
H 4.995090 1.224832 1.520084
H 6.056132 1.412237 0.119168
H -1.516837 -1.318645 -2.139704
H -1.075140 0.413393 -1.838470
H -3.714374 -1.951343 -1.493607
H -3.943841 1.680501 1.895817
H -1.634151 2.207911 1.581935
H -0.580680 0.953444 0.796296
H -5.800179 -1.585298 -0.203673
H -5.916021 0.234673 1.490404
H -1.991620 2.925824 -0.695342


%chk=000188637-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188637

0 1
O 3.237579 -1.087747 -0.239276
O -0.405137 -0.950972 -0.247642
O -1.310177 2.494128 -0.198408
C 2.867263 0.371182 -0.077371
C 1.924701 -1.648986 0.213067
C 0.956759 -0.956519 -0.801120
C 1.603809 0.458974 -0.989194
C 2.406870 0.419458 1.413783
C 1.747359 -0.988708 1.611990
C 4.056027 1.249328 -0.502666
C 1.949029 -3.166645 0.169255
C 3.705370 2.752475 -0.373610
C 5.355589 0.908725 0.263944
C -1.406294 -0.494559 -1.237361
C -2.741832 -0.314388 -0.544258
C -2.927732 0.690871 0.454550
C -3.834783 -1.135826 -0.904826
C -4.198195 0.831643 1.063094
C -1.788984 1.599224 0.886945
C -5.102254 -0.982866 -0.295715
C -5.285489 0.005558 0.694961
H 0.957756 -1.523337 -1.756625
H 1.906090 0.628233 -2.038065
H 0.910453 1.264933 -0.689418
H 1.701279 1.249006 1.595980
H 3.270843 0.550606 2.086715
H 2.290011 -1.581489 2.368343
H 0.684988 -0.934868 1.899899
H 4.232500 1.027212 -1.576411
H 2.205775 -3.526168 -0.843275
H 2.694091 -3.567339 0.878613
H 0.955331 -3.565584 0.440305
H 2.803250 3.016979 -0.954605
H 3.523029 3.027501 0.682288
H 4.542195 3.373945 -0.741650
H 5.561609 -0.173974 0.217301
H 5.289080 1.203634 1.328219
H 6.212046 1.452101 -0.176655
H -1.489940 -1.247455 -2.049831
H -1.071308 0.469589 -1.669789
H -3.689171 -1.912346 -1.665549
H -4.337430 1.598089 1.836208
H -2.092335 2.200004 1.768179
H -0.898399 1.003576 1.139447
H -5.934340 -1.632276 -0.589205
H -6.260857 0.131126 1.177887
H -2.074025 3.040752 -0.514346


