%chk=000190228.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190228

0 1
O -1.972173 1.423070 0.498415
O 1.453005 -0.464739 -1.111051
O -3.012723 -0.338915 1.513829
N -3.952788 0.686738 -0.371800
C -3.807940 1.792495 -1.374751
C -5.221072 -0.122225 -0.339318
C -3.945063 1.229988 -2.794050
C -4.830412 2.901344 -1.103456
C -4.891582 -1.607291 -0.513173
C -5.987711 0.133375 0.961727
C -3.009868 0.491276 0.624361
C -0.802351 1.197206 1.339087
C 0.235442 0.471427 0.565410
C 2.116534 -0.696654 0.110569
C 3.369746 -1.469368 -0.028397
C 1.409503 -0.145286 1.146195
C 0.298224 0.258338 -0.787935
C 4.567420 -0.693722 0.458689
C 5.326100 -1.168914 1.537222
C 4.933063 0.501854 -0.179557
C 6.446384 -0.452777 1.970565
C 6.051906 1.212694 0.259343
C 6.811703 0.736638 1.333811
H -2.770829 2.221388 -1.258362
H -5.843574 0.222294 -1.208239
H -3.258263 0.390154 -2.957552
H -3.712873 1.998581 -3.539767
H -4.956560 0.865604 -3.006123
H -4.683512 3.743959 -1.788352
H -5.863760 2.559215 -1.223430
H -4.732444 3.288221 -0.081185
H -4.332563 -1.794492 -1.435765
H -5.800357 -2.215860 -0.535693
H -4.270796 -1.977264 0.320093
H -6.936689 -0.411318 0.976179
H -5.408268 -0.202796 1.837213
H -6.204377 1.196468 1.106356
H -0.496922 2.234103 1.584355
H -1.099447 0.649653 2.258688
H 3.267307 -2.436046 0.516962
H 3.523184 -1.758196 -1.096659
H 1.655196 -0.155464 2.189431
H -0.310079 0.496821 -1.629360
H 5.047185 -2.091718 2.041370
H 4.338490 0.876092 -1.012015
H 7.034400 -0.824375 2.808299
H 6.332968 2.140735 -0.236163
H 7.683436 1.291988 1.672987


%chk=000190228-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190228

0 1
O -2.007023 1.080668 0.651390
O 1.677577 -0.576130 -0.725177
O -3.418442 -0.622496 1.460913
N -4.085487 0.755132 -0.327563
C -3.760356 1.886834 -1.253030
C -5.410151 0.063585 -0.471926
C -3.680941 1.406288 -2.721864
C -4.753123 3.060781 -1.079506
C -5.246567 -1.421763 -0.871313
C -6.293608 0.237579 0.785603
C -3.215627 0.320198 0.645595
C -0.983303 0.639572 1.623719
C 0.205243 0.059821 0.906636
C 2.216859 -0.971458 0.522691
C 3.557830 -1.646516 0.492296
C 1.341730 -0.597668 1.528778
C 0.446256 0.056603 -0.454463
C 4.752075 -0.686196 0.561519
C 5.762638 -0.866611 1.537523
C 4.872715 0.388173 -0.357329
C 6.874186 0.006078 1.597619
C 5.981711 1.260582 -0.299649
C 6.987354 1.073160 0.678174
H -2.761895 2.238022 -0.951125
H -5.908640 0.585638 -1.309878
H -2.940907 0.593427 -2.829800
H -3.374486 2.244360 -3.374023
H -4.655950 1.036688 -3.089549
H -4.445849 3.906374 -1.721482
H -5.783001 2.780220 -1.368386
H -4.767858 3.409107 -0.031913
H -4.645009 -1.518587 -1.792922
H -6.239926 -1.870222 -1.056499
H -4.750534 -1.985336 -0.064619
H -7.291390 -0.203403 0.605583
H -5.836127 -0.269398 1.650544
H -6.425970 1.306835 1.029945
H -0.707835 1.544806 2.195042
H -1.441223 -0.098325 2.308594
H 3.611619 -2.358444 1.335258
H 3.621000 -2.247536 -0.436066
H 1.487784 -0.771074 2.594054
H -0.108942 0.416620 -1.313858
H 5.680736 -1.692856 2.255020
H 4.092390 0.540364 -1.112176
H 7.647043 -0.146596 2.359678
H 6.062388 2.086417 -1.015841
H 7.847239 1.750980 0.722784


