%chk=000199014.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199014

0 1
O -1.376852 -1.992561 1.806056
O -1.857296 2.098719 -0.584460
O 3.887092 -4.167680 -0.879764
N 0.178045 -0.366173 0.863053
N -0.018589 0.753845 -0.024724
C -2.131893 0.019023 0.695492
C -3.602530 -0.047539 0.887861
C -4.344689 -0.107267 -0.457010
C -1.171851 -0.852148 1.124651
C -1.457317 1.114069 -0.020730
C -5.862420 -0.196247 -0.253705
C 1.131375 -1.358828 0.370966
C 1.033525 1.740686 -0.081701
C -6.605017 -0.249602 -1.587124
C 1.194425 -1.754409 -0.980935
C 2.017403 -1.886203 1.323007
C 0.904200 2.748770 -1.058806
C 2.165930 1.694391 0.748651
C 2.130248 -2.699415 -1.378510
C 2.955940 -2.844666 0.937918
C 1.919453 3.693544 -1.201259
C 3.174220 2.647325 0.582589
C 3.000671 -3.236025 -0.408889
C 3.058247 3.644941 -0.388767
H -3.860409 -0.931568 1.508699
H -3.938910 0.842185 1.464298
H -4.093494 0.791874 -1.057569
H -3.987944 -0.972486 -1.046524
H -6.112107 -1.091014 0.349181
H -6.214800 0.674564 0.333833
H -7.688433 -0.306316 -1.435540
H -6.308707 -1.122095 -2.180059
H -6.404534 0.641206 -2.194287
H 0.513912 -1.307321 -1.711713
H 1.981477 -1.542807 2.359139
H 0.009736 2.798926 -1.685215
H 2.262207 0.933851 1.519948
H -0.531505 -2.498119 1.978455
H 2.211205 -3.027883 -2.414594
H 3.643894 -3.263310 1.666519
H 1.821376 4.476229 -1.953440
H 4.055355 2.611506 1.221996
H 3.846547 4.383651 -0.510957
H 4.495413 -4.502024 -0.173133


%chk=000199014-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000199014

0 1
O -1.379477 -2.000368 1.697701
O -1.921210 2.308036 -0.444239
O 3.963626 -4.169064 -0.867148
N 0.133280 -0.332284 0.780250
N -0.042410 0.886518 0.040471
C -2.143310 0.134726 0.719564
C -3.633402 0.072257 0.912701
C -4.403947 -0.208718 -0.406886
C -1.182384 -0.773462 1.101941
C -1.457726 1.235558 0.042245
C -5.935421 -0.209996 -0.205225
C 1.134657 -1.284212 0.348756
C 1.050907 1.796118 -0.104234
C -6.707806 -0.504007 -1.509510
C 1.487519 -1.434091 -1.017065
C 1.755153 -2.088495 1.335901
C 0.953607 2.823107 -1.080633
C 2.215130 1.687607 0.699879
C 2.440499 -2.395449 -1.391490
C 2.692978 -3.075433 0.957306
C 2.020107 3.732236 -1.238533
C 3.279390 2.595495 0.515357
C 3.033811 -3.226460 -0.408141
C 3.190760 3.622300 -0.452127
H -3.878298 -0.707258 1.658223
H -3.982716 1.042037 1.319678
H -4.128072 0.562271 -1.152118
H -4.081380 -1.186750 -0.817582
H -6.204258 -0.963376 0.563854
H -6.248571 0.774405 0.198480
H -7.801204 -0.495672 -1.344890
H -6.433894 -1.495894 -1.916299
H -6.476087 0.251259 -2.283921
H 1.019547 -0.792290 -1.769345
H 1.551161 -1.901856 2.396575
H 0.043631 2.912861 -1.677252
H 2.279568 0.913037 1.468643
H -0.552733 -2.554811 1.671140
H 2.734491 -2.526175 -2.436764
H 3.169296 -3.697436 1.725332
H 1.934610 4.528187 -1.986574
H 4.175897 2.504183 1.138919
H 4.017952 4.327119 -0.588222
H 4.339330 -4.700163 -0.121821


