%chk=000273562.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273562

0 1
O 6.296961 -3.624906 0.087510
O 7.018737 -1.740097 0.861480
N 0.805809 1.134441 -0.293098
N 1.051949 -0.181694 -0.589474
N 6.145292 -2.446171 0.378441
C -4.290031 -1.366031 0.246730
C -3.527163 -0.520809 -0.782323
C -5.483946 -2.085901 -0.394742
C -2.333086 0.195269 -0.138985
C -6.245266 -2.932523 0.633956
C -1.566552 1.038142 -1.169007
C -7.440177 -3.653801 -0.005589
C -0.352340 1.680222 -0.544870
C -8.201040 -4.498215 1.014018
C -0.487472 3.110585 -0.152687
C -0.606911 4.093958 -1.146369
C -0.510479 3.467414 1.202878
C -0.758616 5.432900 -0.777849
C -0.665517 4.809706 1.561808
C 2.335311 -0.697267 -0.335451
C -0.791293 5.791628 0.574325
C 2.557922 -2.062538 -0.657507
C 3.377838 0.085126 0.221123
C 3.802783 -2.626049 -0.421858
C 4.615937 -0.488056 0.451581
C 4.834565 -1.845232 0.132098
H -4.642057 -0.722791 1.076839
H -3.609241 -2.106814 0.708904
H -3.183811 -1.163624 -1.615446
H -4.211825 0.221448 -1.238051
H -5.135597 -2.728721 -1.226032
H -6.168835 -1.345997 -0.852494
H -1.660594 -0.542279 0.339018
H -2.683920 0.850960 0.684371
H -5.563570 -3.673557 1.093963
H -6.596612 -2.292077 1.465822
H -1.279509 0.425132 -2.046613
H -2.240951 1.820270 -1.580957
H -7.091115 -4.297261 -0.836835
H -8.125782 -2.913975 -0.463351
H -7.560942 -5.268099 1.459806
H -9.051900 -5.008952 0.549124
H -8.594733 -3.885680 1.833154
H -0.571222 3.817028 -2.198294
H -0.399091 2.702544 1.970281
H 0.339153 -0.787626 -1.006654
H -0.848281 6.199696 -1.546136
H -0.683882 5.089926 2.614262
H -0.910522 6.836319 0.857129
H 1.764519 -2.670297 -1.085306
H 3.196423 1.135684 0.463490
H 3.996166 -3.678384 -0.662630
H 5.436419 0.099324 0.881402


%chk=000273562-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273562

0 1
O 6.183933 -3.869177 0.292330
O 6.967757 -1.943118 1.241497
N 0.888258 1.244449 -0.233813
N 1.115353 -0.077684 -0.548615
N 6.045107 -2.626798 0.639270
C -4.293786 -1.381600 0.168448
C -3.428971 -0.581376 -0.831329
C -5.450757 -2.151229 -0.508286
C -2.292452 0.212300 -0.149642
C -6.311961 -2.959825 0.487855
C -1.435018 1.018131 -1.170603
C -7.479832 -3.715177 -0.187013
C -0.290364 1.788167 -0.523080
C -8.333121 -4.522623 0.814780
C -0.462478 3.215825 -0.145114
C -1.746531 3.830762 -0.145833
C 0.661597 4.006138 0.237005
C -1.901184 5.185253 0.221764
C 0.505604 5.356455 0.600215
C 2.340237 -0.679642 -0.250044
C -0.778071 5.956407 0.594671
C 2.539936 -2.044718 -0.614808
C 3.379893 0.036188 0.413140
C 3.751948 -2.684365 -0.324703
C 4.592052 -0.604130 0.702340
C 4.775069 -1.959686 0.333637
H -4.710583 -0.688914 0.928998
H -3.650799 -2.098135 0.720912
H -2.998837 -1.278568 -1.581624
H -4.077115 0.120274 -1.396979
H -5.036717 -2.838997 -1.275402
H -6.098710 -1.432716 -1.052826
H -1.646853 -0.481054 0.426856
H -2.723151 0.913074 0.592205
H -5.668630 -3.687959 1.024938
H -6.718828 -2.275653 1.261885
H -1.048387 0.323354 -1.947468
H -2.088958 1.716774 -1.720246
H -7.073826 -4.397048 -0.962100
H -8.124007 -2.986867 -0.720942
H -7.719805 -5.281172 1.336883
H -9.162808 -5.049687 0.308852
H -8.772775 -3.860431 1.584546
H -2.637023 3.255062 -0.419657
H 1.650813 3.539822 0.235126
H 0.397987 -0.643505 -1.019475
H -2.899324 5.637102 0.218090
H 1.383830 5.947280 0.883500
H -0.898268 7.008588 0.874948
H 1.742042 -2.597196 -1.125936
H 3.207794 1.078037 0.689294
H 3.927575 -3.728834 -0.594535
H 5.405051 -0.079258 1.210994


