%chk=000271561.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271561

0 1
O 0.517247 0.120269 -0.120759
O 1.681422 -1.665169 0.839734
N -2.155182 2.249033 -0.774243
N -0.622448 -0.693812 -0.198252
N 2.720594 -0.001615 -0.474306
C -2.998374 -0.812185 -0.173722
C -1.733300 -0.037144 -0.046204
C -1.871505 1.420299 0.266369
C -3.965853 -0.411813 -1.107518
C -3.214453 -1.936076 0.637686
C -5.156289 -1.134221 -1.217298
C -4.410647 -2.649499 0.521844
C -1.711538 1.873576 1.588646
C 4.110081 -0.309694 -0.302330
C -5.381024 -2.249309 -0.402411
C -1.850769 3.241266 1.839541
C 5.040336 0.533614 -0.943464
C 4.541257 -1.406623 0.461878
C -2.139896 4.109141 0.782331
C -2.284404 3.574742 -0.508902
C 6.402948 0.264008 -0.810620
C 5.909968 -1.653952 0.580236
C 6.843004 -0.825119 -0.050970
C 1.672980 -0.681772 0.152775
H -3.783734 0.455963 -1.746269
H -2.448578 -2.256233 1.345287
H -5.909462 -0.828368 -1.941949
H -4.582663 -3.522336 1.150041
H -1.481888 1.174147 2.390717
H -6.311192 -2.808614 -0.490859
H -1.733489 3.626809 2.852932
H 4.711114 1.382452 -1.536946
H 3.818960 -2.063865 0.955675
H 2.484171 0.803244 -1.064558
H -2.251938 5.177370 0.952454
H -2.511258 4.214046 -1.370673
H 7.128531 0.910296 -1.304653
H 6.250092 -2.504880 1.171554
H 7.906977 -1.027177 0.047207


%chk=000271561-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271561

0 1
O 0.451411 -0.060230 0.067982
O 1.664668 -2.072899 0.549205
N -2.492877 2.003712 -1.028583
N -0.769717 -0.882046 0.080904
N 2.690793 -0.015214 -0.043173
C -3.139663 -0.860741 -0.082738
C -1.850708 -0.117607 0.002347
C -1.841271 1.386300 0.006925
C -4.373278 -0.206239 0.180451
C -3.150103 -2.248734 -0.403692
C -5.587761 -0.923252 0.129912
C -4.364539 -2.959024 -0.453166
C -1.196156 2.111359 1.042258
C 4.083054 -0.296184 0.048791
C -5.589893 -2.300520 -0.186374
C -1.234722 3.521697 1.013270
C 4.981400 0.758890 -0.264899
C 4.589043 -1.565090 0.435808
C -1.896530 4.167710 -0.056632
C -2.503067 3.367511 -1.051937
C 6.373078 0.549445 -0.191079
C 5.985957 -1.756219 0.505581
C 6.885783 -0.710782 0.196062
C 1.638335 -0.874663 0.222649
H -4.386156 0.860941 0.419314
H -2.200152 -2.750558 -0.609916
H -6.531696 -0.406275 0.334649
H -4.359290 -4.025290 -0.704669
H -0.686930 1.574632 1.847177
H -6.534306 -2.854524 -0.229612
H -0.757128 4.104291 1.807968
H 4.590527 1.739305 -0.566508
H 3.897378 -2.376770 0.670716
H 2.420676 0.925930 -0.338714
H -1.946533 5.259279 -0.119937
H -3.023835 3.823342 -1.901761
H 7.055392 1.370743 -0.436366
H 6.371618 -2.737315 0.804553
H 7.966995 -0.874111 0.253234


