%chk=000202729.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202729

0 1
O 3.150271 0.512596 1.209323
O 1.686316 2.604520 0.239031
O -1.739746 -3.394674 0.270859
O -4.875261 -0.001415 -0.490931
O -2.714675 1.919942 -0.379974
O 2.255868 3.473427 -1.809935
N 0.448115 -1.376799 0.143660
N 3.795654 -2.442385 -0.207478
N 3.867283 3.010214 -0.181493
C 2.736195 -1.821226 0.631804
C 2.575939 -0.310263 0.187918
C 1.101022 -0.135393 0.038990
C 1.356372 -2.514167 0.383597
C 0.131401 0.857632 -0.134469
C -0.901341 -1.205300 0.022377
C -1.128385 0.188690 -0.150612
C 0.335338 2.324319 -0.234650
C -1.984655 -2.222590 0.071566
C -2.469663 0.734321 -0.290089
C -3.339525 -1.660292 -0.133005
C -3.564604 -0.326416 -0.303083
C 5.160177 -2.111259 0.290413
C -4.461341 -2.642015 -0.154498
C 2.592561 3.057790 -0.723426
C -5.253459 1.395518 -0.644185
H 2.971024 -1.827597 1.726629
H 3.153917 -0.080419 -0.736201
H 1.367486 -3.190482 -0.503567
H 1.013575 -3.120483 1.249543
H 3.683316 -3.462675 -0.230597
H 0.191036 2.710851 -1.268683
H -0.317108 2.893787 0.460775
H 2.453820 1.068754 1.643794
H 5.889762 -2.434933 -0.471625
H 5.427371 -2.576013 1.251107
H 5.269575 -1.018072 0.404033
H -4.167008 -3.612764 0.273732
H -4.803308 -2.825291 -1.184564
H -5.330564 -2.269898 0.409620
H -4.989631 1.963411 0.253632
H -6.339485 1.306187 -0.768325
H -4.775678 1.825183 -1.530631
H 4.048592 2.401993 0.615010
H 4.650949 3.196687 -0.792393


%chk=000202729-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202729

0 1
O 3.239122 0.500989 1.208608
O 1.810393 2.579538 0.219062
O -1.703962 -3.482632 0.048249
O -4.916032 0.021984 -0.397064
O -2.710005 1.965485 -0.328632
O 2.133033 3.913260 -1.706680
N 0.460021 -1.397284 0.093185
N 3.854724 -2.567385 0.029190
N 3.935055 3.005950 -0.491110
C 2.711722 -1.879500 0.647023
C 2.604401 -0.373385 0.202468
C 1.114070 -0.164030 0.062009
C 1.367867 -2.552440 0.222914
C 0.148453 0.853377 -0.080758
C -0.899622 -1.218276 -0.033158
C -1.123859 0.175401 -0.134651
C 0.384330 2.338354 -0.123893
C -1.959059 -2.228567 -0.047621
C -2.474229 0.711017 -0.254640
C -3.340165 -1.699395 -0.180441
C -3.579613 -0.329912 -0.280214
C 5.177490 -2.181278 0.565063
C -4.479267 -2.688207 -0.205040
C 2.610711 3.237856 -0.768730
C -5.399497 1.413216 -0.558487
H 2.769811 -1.847312 1.762196
H 3.130352 -0.249120 -0.765357
H 1.476370 -3.058155 -0.754995
H 0.969939 -3.274282 0.952774
H 3.728021 -3.587334 0.010238
H 0.180494 2.783078 -1.115557
H -0.233507 2.872221 0.617196
H 2.669566 1.323540 1.260319
H 5.966175 -2.729862 0.021631
H 5.296207 -2.372774 1.657587
H 5.338101 -1.101424 0.405838
H -4.083686 -3.712939 -0.125851
H -5.067306 -2.592081 -1.136275
H -5.183523 -2.502664 0.626939
H -5.141908 2.026957 0.318587
H -6.489885 1.292777 -0.651995
H -4.974331 1.879734 -1.461080
H 4.205885 2.290875 0.190840
H 4.634642 3.467627 -1.066689


