%chk=000209744.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209744

0 1
O -6.210683 -0.456150 1.052605
O -1.159902 1.220554 -0.984749
N 0.299023 -0.505124 -0.440484
N -1.936673 -0.959523 -1.133015
C 3.673333 0.810424 0.243250
C 2.760996 -0.276074 0.079427
C 2.941688 2.113136 0.027052
C 1.439047 0.314846 -0.243176
C 1.527774 1.670176 -0.277136
C 5.003483 0.577022 0.553152
C 3.187943 -1.587684 0.228474
C -3.337869 -0.487895 -1.286592
C -4.111500 -0.517490 0.037489
C -0.953047 0.027751 -0.844858
C 5.429745 -0.754341 0.701841
C 4.538387 -1.817504 0.542590
C -5.535922 0.006620 -0.144865
C -7.549403 0.050136 1.188399
H 2.979429 2.763150 0.922154
H 3.372340 2.696957 -0.808933
H 0.739263 2.375023 -0.487937
H 5.704557 1.397700 0.679522
H 2.506719 -2.424766 0.109507
H 0.466480 -1.508565 -0.468609
H -3.325530 0.548156 -1.707487
H -3.821328 -1.144005 -2.045547
H -4.159528 -1.544448 0.455851
H -3.590241 0.086369 0.809057
H -1.852026 -1.879755 -0.704899
H 6.472138 -0.955631 0.945260
H 4.891022 -2.840298 0.663039
H -6.043306 -0.427142 -1.023637
H -5.576152 1.107917 -0.193678
H -7.881945 -0.404266 2.130359
H -8.176231 -0.283721 0.356789
H -7.544284 1.141146 1.268886


%chk=000209744-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209744

0 1
O -6.476548 -0.570498 1.092921
O -1.110167 1.516126 -0.858612
N 0.366278 -0.257571 -0.396242
N -1.914391 -0.682098 -0.755084
C 3.855347 0.794959 0.121961
C 2.832324 -0.196409 0.047001
C 3.236639 2.158091 -0.145038
C 1.556638 0.486653 -0.263780
C 1.767739 1.843392 -0.378650
C 5.180829 0.429210 0.406879
C 3.133437 -1.561124 0.257567
C -3.311350 -0.303315 -1.004666
C -4.231031 -0.586775 0.205460
C -0.902589 0.278567 -0.681300
C 5.487268 -0.940676 0.618873
C 4.471461 -1.924778 0.544413
C -5.679102 -0.167740 -0.069113
C -7.879406 -0.184029 0.962626
H 3.380747 2.849320 0.710716
H 3.697804 2.654081 -1.023791
H 1.000523 2.582015 -0.602417
H 5.971225 1.186553 0.466339
H 2.362989 -2.342078 0.205750
H 0.452274 -1.268123 -0.277684
H -3.296032 0.776059 -1.237736
H -3.688435 -0.836794 -1.901322
H -4.224424 -1.666937 0.451951
H -3.855025 -0.044602 1.091594
H -1.712120 -1.664846 -0.566053
H 6.516911 -1.241523 0.842269
H 4.724919 -2.977814 0.711003
H -6.068529 -0.664692 -0.988691
H -5.747881 0.933779 -0.220398
H -8.382381 -0.527968 1.880078
H -8.355785 -0.663581 0.080019
H -7.992360 0.917869 0.872260


