%chk=000224635.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224635

0 1
O -3.771834 0.564623 -0.451359
N 2.408355 2.707470 -0.469584
N 1.371748 -2.557413 0.617228
N -2.097801 -1.227028 -1.499895
C 3.288215 -0.901698 0.498505
C 2.732262 -2.275280 0.053001
C 2.649506 0.258919 -0.267158
C 3.087165 1.618982 0.306597
C 3.656296 -3.403943 0.531575
C 0.241737 -2.069146 -0.115949
C 0.963066 2.837369 -0.088210
C 3.148685 3.998968 -0.383261
C -0.638483 -1.081635 0.475696
C -0.087243 -2.609214 -1.356348
C -1.795207 -0.702619 -0.254391
C 0.190087 3.543931 -1.202716
C 3.306714 4.603280 1.016047
C -0.382817 -0.472466 1.744801
C -1.272201 -2.133406 -2.011285
C 0.710012 -3.674116 -2.029178
C -2.690421 0.285568 0.329046
C -1.246419 0.460401 2.260465
C -2.416561 0.852551 1.557818
C -4.753227 1.534407 0.050178
C -5.782401 1.565801 -1.061807
H 4.385103 -0.886280 0.342593
H 3.150180 -0.768036 1.587728
H 2.674300 -2.298273 -1.066034
H 2.914130 0.211611 -1.342217
H 1.541953 0.186941 -0.239911
H 4.186880 1.731990 0.194745
H 2.872875 1.666256 1.395157
H 1.327428 -2.306118 1.612727
H 3.223178 -4.387026 0.302370
H 4.634416 -3.349082 0.043407
H 3.819928 -3.375958 1.614178
H 0.819099 3.370500 0.875816
H 0.543022 1.812155 0.050770
H 2.625027 4.724124 -1.046549
H 4.151021 3.835429 -0.838557
H -0.889794 3.453335 -1.046364
H 0.421956 3.098786 -2.180427
H 0.436866 4.608401 -1.264879
H 3.811484 5.573931 0.968013
H 3.897409 3.959724 1.675330
H 2.335155 4.763985 1.497092
H 0.509360 -0.759287 2.297615
H -1.538370 -2.534478 -2.998407
H 1.518559 -3.245968 -2.638554
H 1.172041 -4.354108 -1.294179
H 0.093616 -4.295651 -2.692366
H -1.049847 0.922611 3.228215
H -3.069271 1.590294 2.009483
H -4.245735 2.502960 0.194372
H -5.161202 1.158388 1.003595
H -5.325992 1.867557 -2.016167
H -6.211233 0.567141 -1.232807
H -6.599779 2.258039 -0.835707


%chk=000224635-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224635

0 1
O -4.378805 0.019126 -0.562962
N 2.850465 2.901537 -0.411245
N 1.238758 -2.206735 0.596625
N -2.380852 -1.477862 -1.596072
C 3.346156 -0.850594 0.494175
C 2.646817 -2.189576 0.118436
C 2.736540 0.389874 -0.193876
C 3.428867 1.701248 0.242009
C 3.419514 -3.399587 0.687630
C 0.086466 -1.947907 -0.163032
C 1.559773 3.322437 0.191577
C 3.830120 3.996873 -0.624471
C -0.947357 -1.083432 0.398551
C -0.152124 -2.547277 -1.427233
C -2.169954 -0.905252 -0.354543
C 0.787314 4.342512 -0.665761
C 4.365574 4.711878 0.648587
C -0.791226 -0.400463 1.650333
C -1.388482 -2.249698 -2.078569
C 0.774926 -3.561372 -2.067865
C -3.224256 -0.081552 0.208072
C -1.820833 0.394410 2.156446
C -3.046709 0.552263 1.449462
C -5.490115 0.836819 -0.036294
C -6.613557 0.753751 -1.066037
H 4.419936 -0.933748 0.226065
H 3.313261 -0.727912 1.599340
H 2.622727 -2.256454 -0.981516
H 2.825631 0.299271 -1.293768
H 1.655079 0.441864 0.029878
H 4.499702 1.644346 -0.038612
H 3.400198 1.771961 1.361084
H 1.156080 -1.993232 1.593926
H 2.931526 -4.347393 0.401391
H 4.460804 -3.412585 0.317266
H 3.455424 -3.357184 1.793370
H 1.696297 3.732296 1.225995
H 0.933379 2.417964 0.298937
H 3.369514 4.746992 -1.293369
H 4.683709 3.568504 -1.184839
H -0.215810 4.514921 -0.234435
H 0.664013 3.957979 -1.693586
H 1.298820 5.320745 -0.719549
H 5.102655 5.487248 0.367376
H 4.866005 3.999923 1.330485
H 3.552526 5.208524 1.208708
H 0.144681 -0.465622 2.217202
H -1.582103 -2.712208 -3.056517
H 1.598034 -3.096790 -2.645528
H 1.231411 -4.217847 -1.304657
H 0.210530 -4.197757 -2.772347
H -1.686418 0.917621 3.109795
H -3.833205 1.178622 1.879073
H -5.146493 1.882962 0.104227
H -5.811725 0.435476 0.947446
H -6.273828 1.141969 -2.040964
H -6.933646 -0.292554 -1.205262
H -7.482735 1.348876 -0.730660


