%chk=000294773.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294773

0 1
O -1.496165 -1.685532 0.431810
O -0.449952 0.707068 0.087300
O -1.988800 2.880251 -0.297654
O -6.671394 0.293054 1.497752
O -0.332533 0.512754 -2.197950
O 3.215561 -0.798836 2.737212
O 4.409583 1.889735 -3.638399
O 5.244911 -0.383530 2.102726
O 6.075334 1.415847 -2.335593
N 4.040150 -0.401426 1.934109
N 4.889205 1.475686 -2.599793
C 0.171594 -3.542968 2.080978
C -0.672627 -3.839656 0.835609
C 1.505820 -4.300674 2.051975
C -1.963866 -3.029270 0.808402
C -2.411477 -0.684036 0.339080
C 2.373861 -3.948266 3.256384
C -1.841266 0.585604 0.086036
C -3.804978 -0.814415 0.464536
C -4.597684 0.325935 0.320876
C -2.667734 1.720932 -0.057591
C -4.062810 1.588362 0.062438
C -6.099714 0.184474 0.440695
C 1.673856 0.580745 -0.837608
C 0.210738 0.588034 -1.129769
C 2.561786 1.022363 -1.826309
C 2.146014 0.118611 0.398610
C 3.530742 0.099682 0.633722
C 3.940994 1.001613 -1.559845
C -6.797357 -0.098508 -0.854760
C 4.442227 0.541732 -0.334874
C -2.765149 4.097583 -0.460973
H 0.357126 -2.451438 2.150510
H -0.390006 -3.807384 2.997481
H -0.917265 -4.919224 0.782143
H -0.083718 -3.614510 -0.079669
H 1.320106 -5.392461 2.030785
H 2.053489 -4.069319 1.117729
H -2.667467 -3.376783 0.033804
H -2.460779 -2.959751 1.790379
H 3.327940 -4.486135 3.232307
H 1.880579 -4.199250 4.202023
H 2.607541 -2.873732 3.290813
H -4.260666 -1.775326 0.678212
H -4.714193 2.451458 -0.029282
H 2.188872 1.378308 -2.801192
H 1.439510 -0.226023 1.175099
H -6.438617 -1.030315 -1.314848
H -6.628138 0.700582 -1.590629
H -7.884502 -0.195007 -0.714064
H 5.528897 0.526640 -0.138145
H -3.319829 4.319905 0.455386
H -3.419393 4.015703 -1.333442
H -1.971259 4.838116 -0.631033


%chk=000294773-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294773

0 1
O -1.442605 -1.971271 0.392817
O -0.407751 0.455850 -0.041345
O -1.972708 2.653665 -0.513028
O -6.562878 -1.351905 0.315676
O -0.212548 0.961440 -2.329952
O 3.397940 -0.698152 2.634051
O 4.426778 2.249994 -3.808320
O 5.508083 -0.157161 1.953736
O 6.214355 1.790577 -2.465357
N 4.233233 -0.211416 1.781008
N 4.951160 1.809669 -2.717527
C 0.139009 -3.686324 2.245946
C -0.723837 -4.182233 1.064209
C 1.378830 -4.573173 2.501176
C -1.949763 -3.308562 0.791751
C -2.368452 -0.954815 0.193850
C 2.249685 -4.057409 3.667172
C -1.819088 0.323733 -0.085596
C -3.771498 -1.101096 0.240135
C -4.606672 0.018254 0.002856
C -2.647026 1.452048 -0.303913
C -4.052411 1.294211 -0.270578
C -6.096120 -0.204070 0.056147
C 1.771689 0.789925 -0.920590
C 0.302488 0.762680 -1.214945
C 2.643174 1.279113 -1.920930
C 2.288595 0.307260 0.304214
C 3.682665 0.320885 0.501024
C 4.028125 1.284551 -1.669111
C -7.032375 0.970664 -0.205727
C 4.581798 0.809653 -0.465257
C -2.776312 3.839399 -0.829281
H 0.465088 -2.646966 2.047254
H -0.481504 -3.650384 3.166058
H -1.083092 -5.212149 1.266371
H -0.109354 -4.233490 0.144159
H 1.051211 -5.612655 2.710324
H 1.989181 -4.620336 1.575715
H -2.569485 -3.717149 -0.031262
H -2.577410 -3.198783 1.699661
H 3.127767 -4.708175 3.833208
H 1.670277 -4.026304 4.609431
H 2.619540 -3.034596 3.466641
H -4.255607 -2.059405 0.446332
H -4.705579 2.151464 -0.447320
H 2.246196 1.642314 -2.873470
H 1.621481 -0.077981 1.078152
H -6.863238 1.399601 -1.211003
H -6.874260 1.778248 0.533381
H -8.072836 0.620026 -0.135203
H 5.660799 0.816129 -0.291541
H -3.449094 4.101444 0.009799
H -3.363799 3.685121 -1.753866
H -2.044747 4.645044 -0.983632


