%chk=000218497.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218497

0 1
O -5.400053 0.713046 -0.512269
N 1.956318 -2.058463 0.188059
N -0.043371 1.146782 0.746555
N 4.868098 1.890340 -0.840561
C 1.780984 -0.688870 0.773920
C 0.781293 -2.954959 0.447507
C -0.684626 -0.965206 0.140059
C -0.547139 -2.412268 -0.151010
C 0.388923 -0.169094 0.541860
C -1.844921 -0.123187 0.073430
C -1.421223 1.198002 0.453521
C 2.854221 0.220466 0.201935
C 1.105281 -4.339448 -0.118892
C -3.194270 -0.352269 -0.267655
C -2.318446 2.288013 0.497376
C 4.041078 0.433404 0.914800
C 2.688266 0.845517 -1.041688
C -4.050203 0.734161 -0.215599
C -3.632340 2.051596 0.161532
C 5.020600 1.272982 0.359664
C 3.715343 1.670248 -1.525668
C -5.979612 -0.551667 -0.908906
H 1.928688 -0.799166 1.888297
H 0.665194 -3.026743 1.561240
H -1.403035 -2.979756 0.264354
H -0.582723 -2.579545 -1.246948
H 2.126329 -1.986342 -0.822527
H 0.531723 1.921613 1.009941
H 2.062358 -4.707992 0.276771
H 0.333167 -5.066964 0.152850
H 1.190281 -4.337771 -1.210957
H -3.514026 -1.346053 -0.552787
H -1.975954 3.277621 0.787941
H 4.213580 -0.054461 1.871909
H 1.779664 0.695647 -1.623450
H -4.380330 2.842388 0.172220
H 5.965107 1.465385 0.882566
H 3.627064 2.178529 -2.493314
H -5.516307 -0.908859 -1.832996
H -7.028929 -0.276297 -1.075520
H -5.889450 -1.281561 -0.099357


%chk=000218497-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218497

0 1
O -5.512677 0.679299 -0.543186
N 1.937964 -2.020425 0.232775
N -0.097256 1.172321 0.765311
N 5.006928 1.810645 -0.911744
C 1.771233 -0.634503 0.778398
C 0.777042 -2.926359 0.481683
C -0.706268 -0.931613 0.111422
C -0.548999 -2.407765 -0.163730
C 0.361111 -0.134107 0.530204
C -1.880107 -0.082852 0.060741
C -1.469844 1.232223 0.475547
C 2.874788 0.254290 0.199649
C 1.134504 -4.341405 -0.001859
C -3.238469 -0.319182 -0.290916
C -2.380030 2.310354 0.539612
C 4.165381 0.254149 0.782494
C 2.677411 1.048049 -0.957392
C -4.140505 0.762324 -0.223035
C -3.717537 2.064357 0.187213
C 5.187383 1.038106 0.202930
C 3.760339 1.798446 -1.471611
C -6.017410 -0.620844 -0.977875
H 1.937888 -0.702006 1.876238
H 0.630546 -2.944587 1.581094
H -1.405180 -2.978818 0.249416
H -0.532119 -2.616656 -1.255249
H 2.166700 -1.983875 -0.773485
H 0.485534 1.958217 1.046079
H 2.033057 -4.714206 0.518301
H 0.300132 -5.042239 0.183107
H 1.341179 -4.344506 -1.090091
H -3.558386 -1.316609 -0.606304
H -2.067254 3.312014 0.854199
H 4.371870 -0.356226 1.668248
H 1.699821 1.082423 -1.450135
H -4.467754 2.859910 0.218615
H 6.193770 1.057679 0.636212
H 3.635766 2.419360 -2.366262
H -5.513199 -0.961648 -1.904245
H -7.088629 -0.466076 -1.175664
H -5.892126 -1.388862 -0.188502


