%chk=000224579.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224579

0 1
O 5.561234 0.550364 -0.634259
N 2.814236 0.204976 0.071409
N -1.103536 -0.873937 3.099193
C 0.454588 0.773054 0.524421
C -0.881553 -0.050839 0.610777
C 1.666178 -0.072925 0.995436
C 0.356196 2.071456 1.326614
C 3.742821 -0.971609 -0.006132
C 3.578944 1.420379 0.505764
C -0.898499 -1.288652 -0.294523
C -2.050742 0.845051 0.191136
C 4.855056 -0.647467 -1.016867
C 4.686231 1.692108 -0.523455
C -1.022803 -0.510735 2.005737
C -1.883549 -2.268015 -0.080697
C -2.990562 1.319226 1.116013
C 0.007709 -1.448256 -1.350971
C -2.170771 1.209549 -1.160389
C -1.946766 -3.395922 -0.901323
C -4.038469 2.143908 0.692955
C -0.060264 -2.578449 -2.171909
C -3.217231 2.034319 -1.577414
C -1.033831 -3.555388 -1.949162
C -4.154963 2.504175 -0.651702
H 0.604976 1.039066 -0.556343
H 1.417592 -1.156920 0.951950
H 1.896885 0.132217 2.062037
H -0.451772 2.717480 0.959605
H 1.291708 2.645124 1.244241
H 0.170690 1.894403 2.392218
H 3.164101 -1.853909 -0.354402
H 4.191712 -1.235661 0.975446
H 4.025647 1.311609 1.517790
H 2.872218 2.281111 0.549828
H 5.656913 -1.406251 -1.012343
H 4.454395 -0.515903 -2.037321
H 4.272783 1.925625 -1.520214
H 5.376731 2.488672 -0.196293
H -2.609335 -2.150495 0.724842
H -2.921923 1.057713 2.171791
H 0.779878 -0.697706 -1.543155
H -1.451540 0.841537 -1.892429
H -2.711330 -4.151423 -0.724799
H -4.766050 2.504810 1.419001
H 0.650124 -2.693594 -2.989284
H -3.303971 2.309727 -2.627586
H -1.084076 -4.434791 -2.588318
H -4.971410 3.145283 -0.978215


%chk=000224579-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224579

0 1
O 5.573392 0.438735 -0.760057
N 2.813190 0.088216 0.102178
N -1.189851 -1.005877 3.124568
C 0.450431 0.831083 0.665596
C -0.878023 -0.042781 0.644488
C 1.698690 -0.008070 1.084420
C 0.286152 2.081173 1.561697
C 3.847345 -0.953584 0.354262
C 3.446740 1.433871 0.058410
C -0.818359 -1.252871 -0.338550
C -2.085459 0.855789 0.247466
C 4.937995 -0.889360 -0.725680
C 4.549781 1.464294 -1.013074
C -1.070200 -0.580010 2.016467
C -1.866391 -2.208409 -0.287046
C -3.079399 1.248684 1.175062
C 0.193584 -1.399430 -1.318902
C -2.175661 1.317675 -1.091025
C -1.910654 -3.283864 -1.196899
C -4.143563 2.089545 0.774521
C 0.144314 -2.477020 -2.235460
C -3.232760 2.162540 -1.488847
C -0.904894 -3.420240 -2.182827
C -4.223432 2.552967 -0.556912
H 0.602061 1.163540 -0.379872
H 1.431844 -1.077857 1.159051
H 2.028598 0.308420 2.104320
H -0.514498 2.747854 1.199943
H 1.227971 2.657673 1.585090
H 0.049740 1.794256 2.603352
H 3.362017 -1.947796 0.330745
H 4.320771 -0.823718 1.359088
H 3.887811 1.705276 1.050836
H 2.683335 2.192946 -0.192964
H 5.752234 -1.601215 -0.512489
H 4.493038 -1.117220 -1.718867
H 4.097374 1.302415 -2.015954
H 5.086633 2.427225 -1.000550
H -2.655023 -2.107073 0.468208
H -3.028212 0.897766 2.211880
H 1.043503 -0.708035 -1.355359
H -1.431848 0.996966 -1.829380
H -2.727507 -4.011745 -1.139615
H -4.907278 2.380163 1.504437
H 0.934933 -2.577977 -2.987918
H -3.290198 2.508292 -2.527064
H -0.937371 -4.252737 -2.894496
H -5.048296 3.203623 -0.867579


