%chk=000212367.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212367

0 1
O 2.159537 1.064269 -0.695499
O 0.254733 2.091745 -1.350228
O -1.901670 0.431416 -1.010320
O -1.488946 -1.611200 -0.045282
N 0.237131 -0.113435 -0.445116
N -5.446266 0.174301 0.091070
C 2.604173 -0.231370 -0.110981
C 3.543200 -0.862049 -1.141601
C 3.277585 0.113740 1.219056
C 1.286193 -1.037158 0.073478
C 4.825662 -0.036761 -1.312504
C 4.565200 0.920680 1.004232
C 5.516932 0.209547 0.034271
C 0.798816 1.130768 -0.891162
C -1.110862 -0.536687 -0.461777
C -3.338047 0.134453 -1.096021
C -3.969588 0.322995 0.288278
C -6.203157 1.145753 0.933403
C -5.884852 -1.223300 0.378915
H 3.026718 -0.947255 -2.119007
H 3.796057 -1.893495 -0.826964
H 3.503695 -0.819987 1.770274
H 2.579870 0.695602 1.854457
H 1.277365 -1.992335 -0.494265
H 1.080945 -1.297877 1.133918
H 4.570499 0.935932 -1.784052
H 5.512323 -0.550227 -2.010243
H 5.064318 1.096594 1.974726
H 4.302369 1.921880 0.601583
H 5.861350 -0.747723 0.468562
H 6.426708 0.821309 -0.116277
H -3.657189 0.903454 -1.825749
H -3.478347 -0.879182 -1.504304
H -3.534640 -0.403760 1.009186
H -3.710194 1.332291 0.675170
H -5.920908 2.170542 0.640887
H -6.053763 1.037181 2.017300
H -7.279616 1.037405 0.721315
H -5.307879 -1.923751 -0.246599
H -6.943599 -1.327115 0.090962
H -5.779154 -1.536389 1.428009


%chk=000212367-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212367

0 1
O 2.153823 1.235103 -0.143155
O 0.185495 2.321580 -0.754047
O -1.865770 0.425878 -1.028561
O -1.397185 -1.660121 -0.054547
N 0.263305 -0.039591 -0.256023
N -5.491889 0.147815 0.009290
C 2.611234 -0.196567 0.075460
C 3.346972 -0.649768 -1.204645
C 3.533515 -0.196553 1.305134
C 1.277183 -0.959175 0.306298
C 4.643296 0.158401 -1.444916
C 4.837639 0.597236 1.058882
C 5.572238 0.099929 -0.209267
C 0.775200 1.283381 -0.435130
C -1.053201 -0.504613 -0.416532
C -3.310166 0.056271 -1.141817
C -4.069051 0.538713 0.108836
C -6.423297 1.120364 0.613218
C -5.749981 -1.233776 0.465302
H 2.662525 -0.565572 -2.070892
H 3.595217 -1.725052 -1.086650
H 3.775016 -1.252894 1.545469
H 2.982663 0.219266 2.169731
H 1.249959 -1.928252 -0.216903
H 1.080652 -1.137805 1.379644
H 4.376818 1.211302 -1.656612
H 5.162177 -0.234926 -2.339374
H 5.494161 0.512412 1.945369
H 4.585198 1.668096 0.939207
H 5.915372 -0.944661 -0.053827
H 6.477079 0.711532 -0.386061
H -3.657467 0.584820 -2.040910
H -3.393167 -1.035564 -1.276304
H -3.575351 0.129594 1.023344
H -3.995454 1.639310 0.160459
H -6.257194 2.120618 0.176419
H -6.324339 1.204375 1.724985
H -7.463447 0.821325 0.389256
H -5.058453 -1.937491 -0.028558
H -6.781026 -1.527626 0.198539
H -5.627597 -1.356514 1.570993


