%chk=000273353.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273353

0 1
O -3.825020 0.060634 2.024063
O -1.188665 -3.346564 0.072443
O 0.216965 -4.906489 -1.700846
O -4.082850 -0.645443 -0.108203
O 2.824577 -0.816284 -1.992596
O 0.706091 0.084441 -2.026309
N -1.288457 -1.096253 -0.315250
N 1.058744 -2.215487 -2.044452
N -2.251550 2.585628 1.295654
N -1.002031 3.490834 -0.365077
C -1.864584 -0.793382 1.005444
C -1.101335 0.360823 1.685262
C -0.372970 -2.564291 -2.089667
C -0.986826 -2.399320 -0.675874
C -1.244300 1.653963 0.977875
C -3.356312 -0.472748 0.832990
C -0.522625 -4.035758 -2.548370
C -0.492755 2.231374 -0.052058
C -2.064107 3.692983 0.448236
C 1.447167 -0.884771 -2.013010
C 3.394992 0.529449 -1.862309
C 3.438230 0.926696 -0.415290
C -5.252561 0.320028 2.097126
C 2.970255 2.186511 -0.017331
C 3.957822 0.038668 0.538279
C 3.028257 2.556297 1.329782
C 4.010047 0.411905 1.883270
C 3.547668 1.671550 2.279913
H -1.805360 -1.719857 1.659362
H -0.019687 0.093518 1.751540
H -1.451013 0.443758 2.740084
H -0.908267 -1.887393 -2.814917
H -1.059561 -0.292275 -0.924992
H -1.589625 -4.328640 -2.561225
H -0.072335 -4.195972 -3.548042
H 1.726967 -2.981466 -1.918369
H -2.981616 2.435701 1.969872
H 0.351523 1.814277 -0.585818
H -2.691252 4.570193 0.464573
H -0.183421 -4.897818 -0.781265
H 4.403812 0.363250 -2.290443
H 2.815490 1.228543 -2.495266
H -5.551971 0.989398 1.284130
H -5.795493 -0.629050 2.030009
H -5.365835 0.781377 3.082893
H 2.554048 2.879965 -0.750177
H 4.311652 -0.943377 0.224311
H 2.661562 3.535654 1.636390
H 4.413833 -0.277805 2.622677
H 3.593181 1.963025 3.327777


%chk=000273353-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273353

0 1
O -3.813785 0.041298 2.178954
O -1.237254 -3.246283 0.102119
O 0.090168 -4.821861 -1.755932
O -4.099546 -0.882967 0.059580
O 2.938862 -0.947363 -1.999372
O 0.849298 0.152638 -2.049899
N -1.296413 -0.956300 -0.326523
N 1.028158 -2.180436 -2.050302
N -2.544355 2.775255 1.073513
N -1.627958 3.680471 -0.781918
C -1.803964 -0.595418 0.994509
C -1.119715 0.704878 1.519808
C -0.421852 -2.431696 -2.093889
C -1.035194 -2.253257 -0.678079
C -1.466429 1.939478 0.731507
C -3.343640 -0.502446 0.971958
C -0.653769 -3.874673 -2.591086
C -0.918881 2.520520 -0.420980
C -2.601774 3.805401 0.140562
C 1.540972 -0.910816 -2.029541
C 3.619252 0.375812 -1.784731
C 3.699915 0.723184 -0.312660
C -5.292869 0.041110 2.335033
C 2.936385 1.792739 0.217493
C 4.542147 -0.020870 0.553990
C 3.011668 2.115685 1.591918
C 4.614526 0.295508 1.927875
C 3.849943 1.366694 2.449835
H -1.560214 -1.433244 1.678429
H -0.028575 0.539156 1.481594
H -1.399575 0.830226 2.580173
H -0.885846 -1.704837 -2.785903
H -1.035999 -0.206631 -0.982485
H -1.739214 -4.095740 -2.591497
H -0.255621 -3.992191 -3.612230
H 1.633639 -2.995699 -1.911604
H -3.175037 2.611927 1.858541
H -0.080329 2.161532 -1.014710
H -3.342156 4.601175 0.172997
H -0.304384 -4.724182 -0.839770
H 4.612742 0.200428 -2.227274
H 3.074134 1.145562 -2.356399
H -5.761814 0.648373 1.542657
H -5.676652 -0.990348 2.272647
H -5.471783 0.469723 3.331162
H 2.281758 2.369660 -0.445136
H 5.133355 -0.851293 0.149799
H 2.419591 2.948425 1.987641
H 5.267230 -0.285006 2.589337
H 3.911353 1.616697 3.515088


