%chk=000222805.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222805

0 1
O 0.253913 2.808585 0.556722
O 1.936334 -2.472748 -1.441830
O -5.690935 -0.233369 -0.730598
O 6.066442 0.495106 0.599568
C -1.514482 -0.951603 0.734500
C -2.388953 0.171955 0.091111
C -0.118775 -0.970886 0.102664
C 0.593598 0.383472 0.378167
C 1.973012 0.434543 -0.366081
C -1.760851 1.509937 0.503728
C -3.783718 -0.126972 0.728299
C -0.302383 1.598689 0.012918
C -2.399612 -2.204155 0.630123
C 0.733673 -2.119729 0.662256
C -3.839591 -1.674761 0.821379
C 2.795458 -0.809618 -0.029340
C 2.094993 -2.159889 -0.038987
C -2.483093 0.074759 -1.437456
C 2.732776 1.705702 0.100341
C 1.793735 0.455349 -1.892660
C -4.940871 0.451926 -0.072747
C 4.208529 1.707318 -0.289231
C 4.109005 -0.774308 0.233650
C 4.911856 0.473752 0.230002
C -5.115820 1.942661 0.023380
H -1.392687 -0.723553 1.824174
H -0.208791 -1.113485 -1.006086
H 0.805492 0.442018 1.473686
H -1.800543 1.639522 1.600717
H -2.336168 2.364004 0.091244
H -3.822148 0.302995 1.755440
H -0.261358 1.806877 -1.084182
H -2.140799 -2.956704 1.390315
H -2.288869 -2.696273 -0.351050
H 0.207793 -3.083704 0.527822
H 0.876058 -2.009440 1.754573
H -4.516663 -2.084507 0.045466
H -4.257594 -1.988735 1.790422
H 2.738846 -2.957117 0.403908
H -3.068597 -0.801010 -1.749772
H -2.966260 0.954995 -1.874315
H -1.496236 -0.022366 -1.906429
H 2.645432 1.812640 1.198811
H 2.234969 2.607564 -0.319416
H 2.753452 0.593038 -2.404560
H 1.383550 -0.499788 -2.258972
H 1.127721 1.263537 -2.213220
H 4.711299 2.620671 0.089255
H 4.327811 1.746975 -1.392727
H 0.275337 2.790324 1.531192
H 4.691335 -1.671930 0.453233
H 1.464438 -3.322019 -1.546541
H -5.589227 2.225195 0.972842
H -4.161344 2.484408 -0.044068
H -5.771189 2.315552 -0.778140


%chk=000222805-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222805

0 1
O 0.193036 2.934045 -0.183612
O 1.992955 -2.521234 -1.491548
O -5.765066 -0.088952 -0.673271
O 6.196742 0.315582 0.895562
C -1.534178 -0.921409 0.580344
C -2.456047 0.157913 -0.068873
C -0.117994 -0.955963 -0.028377
C 0.582517 0.435327 0.170164
C 2.078205 0.470452 -0.381335
C -1.784612 1.526674 0.162567
C -3.783140 -0.111248 0.756752
C -0.336744 1.567586 -0.397114
C -2.402660 -2.202139 0.575784
C 0.723821 -2.082393 0.599526
C -3.851280 -1.672304 0.850643
C 2.828848 -0.817672 0.018221
C 2.113357 -2.158012 -0.051482
C -2.712701 -0.080762 -1.581206
C 2.836124 1.692682 0.238175
C 2.092671 0.578402 -1.941699
C -5.039251 0.525959 0.155972
C 4.360547 1.676261 0.001392
C 4.136585 -0.820186 0.427929
C 4.995582 0.382376 0.491273
C -5.380540 1.942159 0.604047
H -1.413824 -0.616769 1.647249
H -0.190278 -1.170572 -1.113223
H 0.651397 0.592524 1.274105
H -1.746773 1.740938 1.253915
H -2.340337 2.353703 -0.318777
H -3.624235 0.328309 1.763387
H -0.370493 1.494837 -1.496657
H -2.081411 -2.933646 1.338304
H -2.347203 -2.707932 -0.407082
H 0.209202 -3.056494 0.480755
H 0.841347 -1.909181 1.689566
H -4.573877 -2.052287 0.108175
H -4.212954 -1.980139 1.847872
H 2.732872 -2.922774 0.461336
H -3.319603 -0.984454 -1.756499
H -3.272080 0.768322 -2.014575
H -1.773413 -0.182957 -2.151268
H 2.653996 1.699596 1.333621
H 2.404600 2.619309 -0.171428
H 3.122627 0.488699 -2.327679
H 1.509124 -0.233278 -2.405900
H 1.692191 1.557290 -2.258837
H 4.855296 2.528547 0.500353
H 4.585860 1.774291 -1.080438
H 0.226231 3.105416 0.792911
H 4.630166 -1.762822 0.699798
H 1.615515 -3.437386 -1.543076
H -5.739488 1.918825 1.652172
H -4.489181 2.595559 0.587663
H -6.172749 2.366783 -0.032075


