%chk=000272011.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272011

0 1
O 4.522975 -0.455151 2.434214
O 3.708506 -1.701480 -1.846895
N -0.971737 1.053275 -0.364422
N 4.122277 -1.038257 0.280777
C 1.935155 0.812120 0.155660
C 0.897484 -0.208191 0.673529
C 1.226922 2.166344 -0.079483
C 3.046743 1.011600 1.215374
C 2.597416 0.322944 -1.152465
C -0.338812 -0.299387 -0.232128
C -0.013164 2.031078 -0.976660
C 3.938935 -0.184883 1.407297
C 3.484656 -0.880283 -0.983691
C -2.229233 0.981504 -1.183076
C -3.284118 0.167985 -0.470243
C -3.987418 -0.827289 -1.163902
C -3.586414 0.423889 0.876084
C -4.988661 -1.556241 -0.514807
C -4.584804 -0.309802 1.520240
C -5.289249 -1.299694 0.826050
H 0.570327 0.088900 1.692224
H 1.347833 -1.212064 0.782236
H 1.920349 2.906444 -0.517053
H 0.909186 2.582749 0.900125
H 2.601519 1.283340 2.198493
H 3.685323 1.881842 0.948541
H 3.196166 1.138058 -1.613073
H 1.816688 0.083884 -1.909212
H -0.070056 -0.751956 -1.210926
H -1.087317 -0.978644 0.238246
H -0.525070 3.017438 -1.038717
H 0.286990 1.759425 -2.011511
H -2.054967 0.589692 -2.209789
H -2.616382 2.021643 -1.305802
H 4.742642 -1.853368 0.400231
H -3.759838 -1.036844 -2.206663
H -3.026984 1.190162 1.414594
H -5.534276 -2.326787 -1.056760
H -4.815638 -0.110265 2.565333
H -6.068254 -1.868431 1.329130


%chk=000272011-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272011

0 1
O 4.545282 -0.358645 2.577239
O 3.964604 -1.623740 -1.840213
N -0.957592 0.945520 -0.467896
N 4.223540 -0.926168 0.353839
C 1.961363 0.816160 0.149527
C 0.934361 -0.264631 0.607272
C 1.187672 2.143046 -0.095493
C 3.023290 1.055511 1.256715
C 2.715419 0.376729 -1.138207
C -0.286844 -0.369181 -0.326762
C -0.037031 1.967146 -1.015712
C 3.975383 -0.111759 1.482402
C 3.659476 -0.802445 -0.935761
C -2.229295 0.861973 -1.224577
C -3.328517 0.112433 -0.476375
C -4.235811 -0.719323 -1.177061
C -3.490643 0.276979 0.922749
C -5.292493 -1.368931 -0.497683
C -4.541405 -0.374482 1.605074
C -5.449028 -1.197961 0.896842
H 0.571372 0.005216 1.617888
H 1.418006 -1.257747 0.687209
H 1.868008 2.905121 -0.526366
H 0.830063 2.527816 0.879737
H 2.549597 1.281263 2.227835
H 3.643587 1.938189 0.993001
H 3.324654 1.224862 -1.515691
H 2.030449 0.097606 -1.954728
H 0.017708 -0.776767 -1.326536
H -1.010944 -1.085583 0.099579
H -0.580876 2.927992 -1.085580
H 0.297678 1.708807 -2.055239
H -2.087854 0.394197 -2.232836
H -2.564284 1.903410 -1.407705
H 4.872885 -1.710983 0.492951
H -4.114648 -0.862173 -2.258585
H -2.775102 0.909461 1.460212
H -5.986382 -2.009963 -1.053379
H -4.654986 -0.240742 2.687178
H -6.264959 -1.702912 1.426237


