%chk=000182794.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182794

0 1
O -4.826496 -2.146548 0.367479
N 1.294602 -0.421185 -0.579028
N 3.810872 2.935442 0.166215
N -5.100599 0.115228 -0.010158
C 3.535681 0.477039 -0.105545
C 5.524164 -0.928132 0.085542
C 4.353544 1.639016 0.120600
C 2.104123 0.704479 -0.304553
C 6.335732 0.234777 0.294392
C 4.141657 -0.784912 -0.108421
C 5.737990 1.501167 0.311597
C 1.610259 1.988201 -0.265741
C 6.157539 -2.227204 0.082153
C -0.107253 -0.513947 -0.389307
C 7.758558 0.064381 0.487431
C 2.511392 3.079084 -0.014991
C 7.501769 -2.345721 0.269160
C 8.317120 -1.177851 0.474614
C -0.807082 -1.475911 -1.155640
C -0.793096 0.264066 0.565476
C -2.865800 -0.836696 -0.045675
C -2.176758 -1.634316 -0.973439
C -2.166157 0.097812 0.729236
C -4.332712 -1.061280 0.135572
C -6.522202 0.220822 0.129813
C -7.329002 -0.874486 0.482610
C -7.099984 1.488823 -0.096091
C -8.707114 -0.694256 0.608749
C -8.479962 1.644340 0.035946
C -9.288281 0.558519 0.388012
H 3.540101 -1.682977 -0.253814
H 6.338464 2.399360 0.476235
H 1.758417 -1.239062 -0.979736
H 0.563732 2.215214 -0.448674
H 5.530016 -3.103808 -0.072626
H 8.363110 0.957725 0.642815
H 2.106962 4.100311 0.022877
H 7.990078 -3.319330 0.268634
H 9.388003 -1.318272 0.619263
H -0.285624 -2.089512 -1.887039
H -0.253012 0.969593 1.197039
H -2.723616 -2.384044 -1.552312
H -2.692761 0.689686 1.481262
H -4.616866 0.978385 -0.269369
H -6.883725 -1.859992 0.655125
H -6.485588 2.341177 -0.371423
H -9.333917 -1.543343 0.882571
H -8.929401 2.621724 -0.137647
H -10.362778 0.687815 0.489014


%chk=000182794-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182794

0 1
O -4.891750 -2.149001 -0.585455
N 1.325631 -0.361307 -0.602112
N 3.988241 2.997609 -0.230348
N -5.179928 0.085173 0.083756
C 3.580784 0.516171 -0.160500
C 5.527845 -0.949766 0.271891
C 4.455428 1.685801 -0.096417
C 2.164784 0.751793 -0.429169
C 6.403533 0.215868 0.299360
C 4.138280 -0.766855 0.046878
C 5.839751 1.502714 0.123241
C 1.727274 2.078392 -0.552847
C 6.101597 -2.253900 0.481471
C -0.081335 -0.443080 -0.512317
C 7.813832 0.020612 0.522603
C 2.670710 3.148537 -0.438559
C 7.468794 -2.404858 0.695233
C 8.334272 -1.255574 0.714037
C -0.738838 -1.515178 -1.182291
C -0.860698 0.448835 0.276326
C -2.918586 -0.766217 -0.332112
C -2.128594 -1.675381 -1.083666
C -2.255478 0.284129 0.357874
C -4.400753 -1.014632 -0.286637
C -6.589450 0.157424 0.270361
C -7.455310 -0.959396 0.116476
C -7.131170 1.422392 0.630869
C -8.840894 -0.791681 0.328691
C -8.516831 1.572236 0.836560
C -9.383104 0.463681 0.687442
H 3.501008 -1.660143 0.078348
H 6.465271 2.400714 0.159101
H 1.790106 -1.221938 -0.898261
H 0.689090 2.313954 -0.795760
H 5.443199 -3.130911 0.467493
H 8.469813 0.898611 0.540304
H 2.314976 4.180586 -0.548443
H 7.895704 -3.401580 0.850898
H 9.407701 -1.394254 0.882667
H -0.150840 -2.216351 -1.787492
H -0.373621 1.231717 0.863154
H -2.638615 -2.503115 -1.586510
H -2.809074 0.960140 1.021756
H -4.685488 0.972174 0.198712
H -7.035448 -1.925340 -0.168240
H -6.465759 2.288015 0.750560
H -9.502661 -1.656866 0.208647
H -8.918882 2.553083 1.113432
H -10.460418 0.578364 0.847196


