%chk=000111093.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000111093

0 1
O 5.257558 -0.193034 -0.405402
O -3.382392 -2.931935 1.885931
O 2.984238 0.266249 -3.841452
O -1.872944 -4.902253 -0.061845
O 5.053655 -0.102107 -3.092617
O -0.030872 -4.442813 1.126431
C -0.316727 0.712522 -0.234253
C 1.146091 0.452897 -0.244475
C -1.214380 -0.302892 -0.255416
C 1.859781 0.304882 0.999517
C -2.684558 -0.143871 -0.297826
C 3.259083 0.080754 0.966838
C -0.674508 2.148508 -0.156007
C -3.485160 -1.108004 0.354939
C 1.809894 0.374152 -1.445055
C -0.751372 -1.699450 -0.153858
C 3.218210 0.153517 -1.507445
C 3.921549 0.012358 -0.312511
C -1.509529 -2.639738 0.439629
C -2.858782 -2.300245 0.997707
C 1.206207 0.363519 2.269151
C -3.309920 0.906742 -0.983011
C 3.977694 -0.077493 2.189636
C -4.878686 -0.977766 0.373742
C -0.244663 3.043161 -1.148289
C -1.421033 2.622458 0.935892
C 1.920332 0.205386 3.432608
C -4.704020 1.020569 -0.975455
C 3.326376 -0.017105 3.396415
C -5.489523 0.090374 -0.288786
C 3.894789 0.081223 -2.806899
C -0.566244 4.399527 -1.050501
C -1.731728 3.980859 1.030556
C -1.027417 -4.030669 0.581535
C -1.306858 4.870533 0.038115
H 1.271985 0.475312 -2.396649
H 0.242902 -1.927696 -0.556705
H 0.128744 0.531990 2.300199
H -2.714747 1.638895 -1.529930
H 5.055558 -0.250903 2.143195
H -5.478879 -1.721205 0.906461
H 0.340987 2.684022 -1.994082
H -1.764644 1.930338 1.704158
H 1.420002 0.244053 4.402130
H -5.179304 1.843270 -1.511056
H 3.866462 -0.141232 4.334535
H -6.573701 0.191407 -0.275695
H -0.233752 5.091556 -1.823631
H -2.308117 4.346892 1.879566
H -1.551353 5.929046 0.114189
H 5.696145 -0.299039 0.490679
H 3.423600 0.214391 -4.731016
H -1.596129 -5.852911 0.051514


%chk=000111093-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000111093

0 1
O 5.203429 -0.335313 -0.895073
O -4.120790 -3.468346 0.294906
O 2.080477 -1.285747 -3.621268
O -1.919901 -5.201233 0.159982
O 4.370130 -1.389437 -3.273570
O -0.049953 -4.245001 1.132483
C -0.356019 0.677411 0.133638
C 1.094657 0.371179 -0.012451
C -1.313018 -0.342507 -0.090405
C 2.094610 0.704827 0.986745
C -2.713617 -0.131976 -0.532093
C 3.491677 0.459300 0.702228
C -0.723479 2.072183 0.498085
C -3.639977 -1.220794 -0.447152
C 1.518156 -0.220927 -1.210823
C -0.910958 -1.711555 0.168361
C 2.889881 -0.468864 -1.525076
C 3.875102 -0.115991 -0.574101
C -1.783442 -2.788058 0.227311
C -3.240662 -2.581970 0.042913
C 1.747862 1.212514 2.280332
C -3.158189 1.076173 -1.147098
C 4.471813 0.765590 1.702187
C -4.981544 -1.055496 -0.880719
C 0.014837 3.177170 -0.012949
C -1.783230 2.329432 1.417963
C 2.723547 1.497500 3.238421
C -4.483121 1.221158 -1.592286
C 4.102181 1.281016 2.946030
C -5.411497 0.158697 -1.440472
C 3.240475 -1.075008 -2.837543
C -0.312534 4.497566 0.359927
C -2.100530 3.646891 1.798663
C -1.170319 -4.103414 0.572592
C -1.370708 4.738883 1.267208
H 0.778960 -0.477727 -1.972682
H 0.134524 -1.909095 0.427534
H 0.693969 1.370045 2.521367
H -2.457489 1.901868 -1.290844
H 5.541760 0.588404 1.525592
H -5.654000 -1.913338 -0.777633
H 0.834101 2.994350 -0.717075
H -2.344655 1.487318 1.836186
H 2.430049 1.881114 4.220969
H -4.795073 2.158903 -2.065164
H 4.865063 1.503676 3.698732
H -6.446219 0.277378 -1.779273
H 0.256877 5.336672 -0.054359
H -2.913107 3.825445 2.511223
H -1.621008 5.763936 1.561992
H 5.811092 -0.051118 -0.166272
H 2.361311 -1.706254 -4.477356
H -1.431597 -6.028427 0.425567


