%chk=000244324.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244324

0 1
O -1.108361 -0.813710 -2.300448
O 0.789422 1.369284 -2.259699
N 0.623013 1.051799 0.045646
N -2.290055 1.091468 -1.528709
C -1.323909 -0.427134 0.160058
C -1.137726 0.182666 -1.297159
C -0.275903 0.354532 1.010471
C 1.922182 1.620198 0.509507
C -2.730415 0.008089 0.514386
C 0.209343 0.967198 -1.269364
C -1.164226 -1.951844 0.206103
C -3.261444 0.840059 -0.514350
C 3.087622 0.740160 0.010713
C 2.071988 3.069171 0.003803
C 4.425248 1.325235 0.477779
C 3.411209 3.651934 0.469841
C 4.589182 2.779467 0.012463
C -3.492893 -0.278140 1.633619
C 0.257811 -2.432527 0.310013
C -4.548302 1.368763 -0.431893
C -4.789887 0.257403 1.727407
C -5.303903 1.064827 0.710443
C 1.103633 -2.395836 -0.809107
C 0.745144 -2.935002 1.527059
C 2.422198 -2.844145 -0.708933
C 2.065079 -3.385234 1.621718
C 2.907302 -3.337824 0.506926
H -0.774919 1.107513 1.659867
H 0.308424 -0.320169 1.669885
H 1.907510 1.619784 1.630526
H -1.630796 -2.380713 -0.714964
H -1.769090 -2.359550 1.042655
H -2.613634 1.159722 -2.492306
H 3.062903 0.685095 -1.097841
H 2.969028 -0.300039 0.368340
H 1.231123 3.691668 0.358289
H 2.013221 3.085371 -1.106951
H 5.256825 0.709377 0.086047
H 4.499073 1.271291 1.580600
H 3.420285 3.750448 1.571986
H 3.526920 4.677704 0.070849
H -0.596905 -0.496508 -3.092177
H 5.538777 3.194858 0.396383
H 4.663985 2.808764 -1.092588
H -3.102518 -0.906651 2.431514
H -4.950881 2.003040 -1.215239
H -5.396477 0.037444 2.602713
H -6.312374 1.469635 0.800825
H 0.721493 -2.016862 -1.759063
H 0.096752 -2.982136 2.398884
H 3.073325 -2.810891 -1.581391
H 2.436819 -3.776359 2.567276
H 3.934079 -3.688392 0.582688


%chk=000244324-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244324

0 1
O -1.229690 -0.801614 -2.351233
O 0.914192 1.029117 -2.319697
N 0.659071 0.914110 0.049416
N -2.198536 1.192997 -1.373954
C -1.380128 -0.419608 0.182530
C -1.151933 0.164888 -1.265651
C -0.368984 0.455545 1.017348
C 1.936834 1.534349 0.489352
C -2.825190 -0.026774 0.486650
C 0.268767 0.769449 -1.251527
C -1.133688 -1.954776 0.309997
C -3.237588 0.956639 -0.457985
C 3.162191 0.719327 0.000801
C 2.025053 3.016868 0.041861
C 4.478466 1.371042 0.487230
C 3.347983 3.657978 0.525157
C 4.576289 2.849664 0.042062
C -3.691525 -0.429563 1.511720
C 0.312473 -2.437892 0.322027
C -4.510523 1.558941 -0.378353
C -4.981418 0.160345 1.601597
C -5.376244 1.144403 0.664659
C 1.008416 -2.716887 -0.883706
C 0.983819 -2.668649 1.552417
C 2.336851 -3.195137 -0.859989
C 2.314983 -3.144024 1.581857
C 2.998757 -3.406371 0.372523
H -0.886219 1.323225 1.469318
H 0.110273 -0.130812 1.820900
H 1.921684 1.506813 1.598776
H -1.684513 -2.431201 -0.519918
H -1.618066 -2.275803 1.251850
H -2.331662 1.686362 -2.256428
H 3.143959 0.686067 -1.104364
H 3.082952 -0.322409 0.363526
H 1.154963 3.577172 0.435840
H 1.970738 3.052862 -1.062580
H 5.340829 0.794864 0.100484
H 4.532666 1.319737 1.595490
H 3.355193 3.703405 1.634740
H 3.408197 4.702600 0.163856
H -0.537269 -0.515161 -3.014708
H 5.508373 3.305416 0.428870
H 4.628764 2.894188 -1.064835
H -3.387511 -1.190229 2.240998
H -4.829650 2.317239 -1.101510
H -5.669861 -0.146240 2.395853
H -6.373175 1.593847 0.740711
H 0.493235 -2.561189 -1.837196
H 0.449832 -2.500020 2.497275
H 2.854913 -3.407019 -1.802273
H 2.810812 -3.321943 2.543072
H 4.028145 -3.781836 0.390243


