%chk=000249350.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249350

0 1
N -2.431222 -3.455636 0.410679
N 0.942120 0.675598 -1.368352
N 1.461669 1.624215 -0.518752
C -1.521137 -2.044344 -1.140885
C -0.847516 -1.522767 -2.357642
C -2.031496 -1.246098 -0.048876
C 0.687041 -1.556574 -2.242344
C -2.599534 -2.154734 0.907521
C -1.777781 -3.373917 -0.839948
C 1.222639 -0.588798 -1.211047
C -2.066508 0.136053 0.216594
C -3.189981 -1.704520 2.107205
C 2.034936 -1.183355 -0.114911
C -2.645350 0.573547 1.394905
C -3.201788 -0.339641 2.329956
C 3.428542 -1.025835 -0.112627
C 1.405379 -1.900490 0.911781
C 4.188956 -1.589130 0.915609
C 2.171469 -2.457573 1.939134
C 3.561883 -2.303893 1.941705
C 0.838664 2.914637 -0.560743
C 1.068669 3.780609 0.529429
C 0.094286 3.354026 -1.673221
C 0.560705 5.079761 0.487724
C -0.406976 4.654395 -1.688299
C -0.178139 5.521851 -0.613537
H -1.157096 -2.109402 -3.247664
H -1.180714 -0.479738 -2.558439
H 1.021783 -2.585399 -1.996339
H 1.134116 -1.313421 -3.230128
H -1.547740 -4.255672 -1.409024
H -2.747926 -4.297951 0.845349
H -1.640025 0.836718 -0.502191
H -3.616198 -2.404235 2.816574
H -2.683412 1.637421 1.620716
H -3.647526 0.057471 3.241264
H 3.914119 -0.466437 -0.911951
H 0.318732 -2.019215 0.903707
H 1.811397 1.327024 0.404735
H 5.271194 -1.470438 0.917193
H 1.683139 -3.011940 2.738856
H 4.156308 -2.740520 2.742233
H 1.640262 3.450885 1.392172
H -0.078686 2.681213 -2.513194
H 0.741443 5.752763 1.325326
H -0.982113 4.998038 -2.547801
H -0.572392 6.533847 -0.636353


%chk=000249350-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249350

0 1
N -2.616368 -3.587410 0.366310
N 0.846413 0.687204 -1.373898
N 1.228282 1.630103 -0.445953
C -1.673498 -2.115331 -1.118055
C -0.977288 -1.555497 -2.336275
C -2.137080 -1.376090 0.048355
C 0.583583 -1.543553 -2.247096
C -2.726400 -2.323955 0.959957
C -1.988983 -3.455505 -0.884325
C 1.151911 -0.590628 -1.198047
C -2.125348 0.000275 0.403478
C -3.293704 -1.938196 2.195295
C 1.992889 -1.132706 -0.084031
C -2.691267 0.391350 1.631761
C -3.267467 -0.566704 2.519419
C 3.253675 -0.548201 0.235030
C 1.570146 -2.273172 0.654405
C 4.060305 -1.085090 1.261774
C 2.373348 -2.800980 1.687718
C 3.621230 -2.210467 1.997353
C 0.875578 2.983346 -0.613719
C 1.185716 3.903063 0.426290
C 0.236278 3.447031 -1.795923
C 0.859951 5.267130 0.281872
C -0.084458 4.814138 -1.921819
C 0.222153 5.735428 -0.891434
H -1.258639 -2.143820 -3.231514
H -1.309182 -0.516486 -2.515085
H 0.952310 -2.565385 -2.049097
H 0.976271 -1.243272 -3.239185
H -1.823624 -4.323365 -1.521326
H -2.970787 -4.456298 0.758806
H -1.683986 0.744167 -0.268385
H -3.740699 -2.669801 2.878168
H -2.692252 1.449991 1.914276
H -3.699293 -0.229099 3.468419
H 3.621942 0.300111 -0.354486
H 0.600793 -2.729071 0.423430
H 1.672925 1.340399 0.435455
H 5.033538 -0.631391 1.480787
H 2.025291 -3.672987 2.252858
H 4.245508 -2.625097 2.796583
H 1.675286 3.548032 1.342410
H 0.007084 2.730916 -2.588684
H 1.103704 5.965663 1.090594
H -0.577832 5.164094 -2.836151
H -0.029758 6.795515 -1.000214


