%chk=000213386.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213386

0 1
O -0.009050 0.508990 -0.133221
O 2.702302 0.513588 0.279077
N -3.329379 0.740720 0.895423
C -2.260755 1.394771 0.076239
C -1.397090 0.300988 -0.583187
C -3.783419 1.629451 2.018066
C -4.487422 0.328564 0.029987
C -1.253967 0.457651 -2.089069
C -2.699918 1.732769 3.090812
C -5.302646 -0.754645 0.737559
C 0.426706 -0.125262 0.998190
C 1.839044 -0.155200 1.152232
C -0.383642 -0.706157 1.978917
C 2.423520 -0.747417 2.270334
C 0.211704 -1.297726 3.098595
C 2.715234 0.120293 -1.060483
C 1.599899 -1.317823 3.249312
C 3.296821 1.077811 -1.927970
C 2.264069 -1.121734 -1.511668
C 3.413317 0.736938 -3.277825
C 3.773927 2.389876 -1.405364
C 2.393578 -1.426732 -2.871296
C 2.964449 -0.504913 -3.749381
H -2.654579 2.105291 -0.678612
H -1.598382 2.002133 0.740760
H -1.719681 -0.724299 -0.298673
H -4.072913 2.644221 1.668626
H -4.696251 1.174111 2.465610
H -5.142952 1.182512 -0.246514
H -4.088938 -0.082558 -0.923860
H -0.526719 -0.267027 -2.487227
H -0.861988 1.448619 -2.357273
H -2.206264 0.309910 -2.605898
H -2.420775 0.740449 3.470137
H -1.779147 2.189488 2.704706
H -3.042055 2.333618 3.939281
H -4.654748 -1.573448 1.079074
H -5.817926 -0.367836 1.624324
H -6.057952 -1.179020 0.068428
H -1.472776 -0.681096 1.882712
H 3.508360 -0.754424 2.368024
H -0.422813 -1.745953 3.862616
H 2.048924 -1.778894 4.125964
H 1.821203 -1.835168 -0.821713
H 3.857551 1.447132 -3.973788
H 3.605922 3.207028 -2.116816
H 3.260023 2.656833 -0.466431
H 4.849435 2.354699 -1.179639
H 2.049776 -2.391770 -3.239054
H 3.065779 -0.747052 -4.804242


%chk=000213386-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213386

0 1
O -0.023139 0.624786 -0.200044
O 2.703070 0.492995 0.233663
N -3.334932 0.747899 1.018284
C -2.375811 1.457416 0.127111
C -1.437220 0.497228 -0.661492
C -3.882107 1.645525 2.078958
C -4.421759 0.098879 0.225376
C -1.374545 0.814216 -2.158559
C -2.855800 2.019867 3.164774
C -5.168283 -1.006594 0.995023
C 0.400163 -0.092088 0.923922
C 1.812146 -0.184641 1.104374
C -0.459787 -0.700446 1.870150
C 2.348066 -0.855392 2.218148
C 0.089094 -1.385626 2.979523
C 2.812202 0.087873 -1.122694
C 1.487527 -1.463486 3.162522
C 3.470064 1.014232 -1.976858
C 2.354868 -1.163718 -1.587337
C 3.649347 0.636923 -3.328482
C 3.944771 2.347369 -1.437517
C 2.547558 -1.510139 -2.943607
C 3.195124 -0.610520 -3.819576
H -2.916606 2.116795 -0.596584
H -1.736447 2.115888 0.738495
H -1.753891 -0.552030 -0.492950
H -4.312726 2.576798 1.628354
H -4.720922 1.113992 2.562208
H -5.151275 0.861481 -0.151200
H -3.958911 -0.354801 -0.671124
H -0.671247 0.136739 -2.670721
H -1.029928 1.851408 -2.318418
H -2.375911 0.706845 -2.615156
H -2.434144 1.112155 3.629717
H -2.015259 2.616139 2.767224
H -3.345146 2.623030 3.951734
H -4.455900 -1.768934 1.356431
H -5.720089 -0.613184 1.867090
H -5.904188 -1.499299 0.333101
H -1.547161 -0.588940 1.762555
H 3.436676 -0.893466 2.325613
H -0.586254 -1.847908 3.708366
H 1.908181 -1.986894 4.027243
H 1.861951 -1.857205 -0.898236
H 4.153040 1.337694 -4.005465
H 4.383617 2.965700 -2.239373
H 3.109987 2.904569 -0.974659
H 4.703702 2.211223 -0.644902
H 2.196969 -2.482445 -3.307960
H 3.348663 -0.875607 -4.871243


