%chk=000255691.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255691

0 1
O 2.765859 0.415516 -1.395030
O -4.252690 -0.316982 -0.201770
O 6.633645 0.962115 0.411287
O -4.352389 1.696656 0.825592
C 2.544657 0.564528 0.049354
C 3.420721 -0.553263 -0.496743
C 1.137681 0.259613 0.549653
C 0.605158 -1.049570 -0.106506
C -0.787548 -1.309296 0.475788
C -1.760732 -0.154521 0.060610
C 2.893472 -1.969036 -0.636388
C 1.593494 -2.197888 0.145954
C 0.176878 1.442854 0.302206
C 3.218040 1.774065 0.672164
C -1.267255 1.136314 0.733092
C 4.926915 -0.442877 -0.446126
C -1.552956 -2.589403 0.098583
C -3.103843 -0.722736 0.610006
C -3.028604 -2.253287 0.417342
C 4.562974 2.076543 0.013189
C 5.483286 0.879584 0.043688
C -1.871310 0.038799 -1.457058
C -4.789699 0.933483 -0.003300
C -5.927145 1.119718 -0.973036
C -7.116596 1.778344 -0.288276
H 1.210677 0.092806 1.654794
H 0.528745 -0.884157 -1.212844
H -0.692413 -1.304124 1.592704
H 3.652746 -2.707868 -0.315759
H 2.718915 -2.163827 -1.717645
H 1.144455 -3.161609 -0.160816
H 1.808525 -2.295397 1.226643
H 0.199031 1.712346 -0.773373
H 0.535129 2.337645 0.845681
H 3.350079 1.601385 1.759979
H 2.559498 2.663907 0.580466
H -1.328670 1.049470 1.833898
H -1.935772 1.983232 0.477143
H 5.338317 -0.625850 -1.466826
H 5.354403 -1.256051 0.181640
H -1.203276 -3.463027 0.668952
H -1.423284 -2.836056 -0.968683
H -3.308243 -0.412569 1.652143
H -3.699594 -2.563457 -0.405488
H -3.379274 -2.781292 1.317749
H 5.051138 2.946652 0.496441
H 4.398267 2.363839 -1.051971
H -2.456308 0.932104 -1.698310
H -0.883633 0.150947 -1.923041
H -2.369121 -0.811933 -1.936534
H -5.565681 1.744322 -1.819380
H -6.217378 0.144300 -1.421449
H -6.822880 2.711166 0.216098
H -7.902795 2.024886 -1.011677
H -7.560417 1.125235 0.473791


%chk=000255691-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000255691

0 1
O 2.986534 0.307228 -1.403556
O -4.317593 -0.228737 -0.363443
O 6.795729 1.159812 0.453015
O -4.650771 1.272039 1.401848
C 2.596466 0.564111 0.049332
C 3.531353 -0.575660 -0.277767
C 1.126153 0.278300 0.383156
C 0.659066 -1.099013 -0.185157
C -0.798415 -1.325756 0.253541
C -1.763491 -0.220501 -0.290633
C 3.027243 -2.022063 -0.334902
C 1.622371 -2.210561 0.280925
C 0.178850 1.433921 -0.055159
C 3.209745 1.838041 0.632730
C -1.311637 1.146449 0.274712
C 5.029070 -0.429796 -0.032178
C -1.514532 -2.659573 -0.094188
C -3.094365 -0.781194 0.288565
C -3.039054 -2.313576 0.033368
C 4.604801 2.147249 0.041204
C 5.577594 0.987832 0.180268
C -1.837386 -0.176609 -1.839663
C -4.999656 0.803793 0.293802
C -6.190281 1.258356 -0.538569
C -7.222075 2.053184 0.283442
H 1.068560 0.200859 1.494701
H 0.709908 -1.052665 -1.292268
H -0.818049 -1.233508 1.365642
H 3.754393 -2.685429 0.171244
H 3.010023 -2.323218 -1.400639
H 1.232067 -3.205461 -0.005303
H 1.687985 -2.197185 1.389278
H 0.308792 1.610482 -1.140312
H 0.466368 2.373928 0.452789
H 3.270738 1.728846 1.734835
H 2.549308 2.701289 0.435767
H -1.450827 1.148563 1.375268
H -1.941678 1.965590 -0.122708
H 5.588831 -0.881102 -0.877014
H 5.318555 -1.021595 0.859226
H -1.220925 -3.477844 0.586157
H -1.265027 -2.985518 -1.121176
H -3.158919 -0.539368 1.366576
H -3.589551 -2.547661 -0.894606
H -3.527169 -2.870192 0.851814
H 5.054448 3.046058 0.497019
H 4.482147 2.333991 -1.044318
H -2.621071 0.534695 -2.154604
H -0.883930 0.148731 -2.287716
H -2.094090 -1.158771 -2.273509
H -5.793146 1.881601 -1.365170
H -6.640409 0.371290 -1.018843
H -6.742295 2.904456 0.795060
H -8.022132 2.439173 -0.372426
H -7.685427 1.418986 1.059141


