%chk=000188805.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188805

0 1
O -4.625586 1.309333 -0.535031
C -0.296539 0.537129 0.012580
C 0.792719 1.471860 0.023331
C -0.010626 -0.850704 -0.011565
C 2.107562 1.026344 0.031193
C 1.352098 -1.295301 -0.027301
C 2.391253 -0.374755 -0.037406
C -1.673179 0.979621 0.036966
C 0.486248 2.947394 0.048311
C -1.105768 -1.790382 -0.021446
C 3.226757 2.036749 0.099441
C 3.813446 -0.874426 -0.107839
C 1.638540 -2.775887 -0.052751
C -1.976407 2.451353 0.051291
C -0.862121 3.268253 -0.601373
C -0.825860 -3.264630 -0.114118
C 4.597689 1.441167 0.434608
C 4.851036 0.205748 -0.428455
C 0.506101 -3.610916 0.554658
C -2.694470 0.050757 0.080283
C -2.400918 -1.344583 0.037129
C -4.134943 0.445178 0.161425
C -4.965709 -0.290108 1.178698
H 0.493137 3.294550 1.103776
H 1.274420 3.529085 -0.471425
H 3.283328 2.562909 -0.878711
H 2.987226 2.813283 0.856137
H 4.065544 -1.349592 0.865587
H 3.892177 -1.675475 -0.873019
H 1.811790 -3.083881 -1.106351
H 2.575329 -3.006798 0.494247
H -2.134077 2.779674 1.100036
H -2.937371 2.658850 -0.477189
H -0.820726 3.044197 -1.686827
H -1.081771 4.348935 -0.518471
H -1.643826 -3.855581 0.342641
H -0.803680 -3.557466 -1.186108
H 5.387964 2.197802 0.275517
H 4.641796 1.170547 1.507693
H 4.798558 0.475357 -1.501575
H 5.870634 -0.186930 -0.259629
H 0.440065 -3.417665 1.644041
H 0.724835 -4.688735 0.443235
H -3.229687 -2.051115 0.036875
H -5.841041 0.306517 1.473764
H -4.399422 -0.536224 2.085146
H -5.352524 -1.231041 0.764980


%chk=000188805-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188805

0 1
O -4.477247 1.655714 1.022874
C -0.294201 0.586141 0.128878
C 0.811856 1.513149 0.044695
C -0.006544 -0.837106 0.119060
C 2.140232 1.043065 -0.021337
C 1.353477 -1.297543 0.034831
C 2.412620 -0.370390 -0.052250
C -1.661690 1.053598 0.266229
C 0.535703 3.011818 0.029479
C -1.102458 -1.776307 0.187078
C 3.288948 2.056612 -0.052664
C 3.846692 -0.890264 -0.180428
C 1.645791 -2.797736 0.059336
C -1.937128 2.550991 0.241667
C -0.859450 3.325799 -0.533167
C -0.830580 -3.269427 0.098981
C 4.678130 1.449064 0.229898
C 4.870727 0.177434 -0.614587
C 0.527765 -3.618026 0.735898
C -2.707630 0.102482 0.401745
C -2.398188 -1.299474 0.335237
C -4.136725 0.495536 0.630215
C -5.233661 -0.550651 0.401594
H 0.610230 3.415927 1.063051
H 1.306246 3.537629 -0.561712
H 3.314037 2.546881 -1.049979
H 3.088230 2.866501 0.673850
H 4.167798 -1.310383 0.797511
H 3.869480 -1.738223 -0.891178
H 1.781910 -3.166756 -0.980991
H 2.603972 -2.988628 0.575578
H -1.992393 2.926242 1.284825
H -2.938941 2.746647 -0.171415
H -0.896438 3.045327 -1.604519
H -1.062099 4.411545 -0.471170
H -1.652358 -3.833554 0.577556
H -0.811192 -3.581676 -0.967121
H 5.462131 2.198080 0.010546
H 4.767029 1.189542 1.304203
H 4.730619 0.425239 -1.686160
H 5.895685 -0.224449 -0.505588
H 0.498857 -3.385025 1.818132
H 0.739844 -4.699043 0.634742
H -3.211540 -2.027879 0.415990
H -6.208172 -0.040209 0.441897
H -5.213765 -1.322214 1.194902
H -5.121609 -1.065602 -0.569212


