%chk=000193426.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193426

0 1
O -0.342393 -2.480203 -0.910830
O 5.797008 0.081104 0.881414
O -4.637652 -0.072238 2.609901
C 1.173242 1.070801 0.277058
C -0.134451 1.048355 -0.527176
C 2.081565 -0.150790 -0.087989
C -0.914247 -0.247677 -0.154224
C -2.264691 -0.336550 -0.926981
C -3.112940 0.947701 -0.648790
C 3.374830 0.192934 0.711713
C 2.117644 2.274951 0.133108
C -0.986322 2.295791 -0.243247
C 1.339643 -1.417652 0.371409
C -2.325637 2.228869 -0.983457
C 3.496245 1.737167 0.581873
C -0.021377 -1.477188 -0.311052
C -3.082518 -1.579823 -0.482952
C -3.622996 1.014902 0.801947
C 2.366527 -0.253370 -1.593447
C -2.008660 -0.469911 -2.439973
C 4.656668 -0.520116 0.241225
C -3.561961 -1.519735 0.966568
C -4.391235 -0.249286 1.194728
C 4.641337 -2.018027 0.533480
H 0.902417 0.994728 1.361361
H 0.096017 1.022152 -1.621528
H -1.173553 -0.190978 0.937555
H -4.004713 0.906484 -1.322748
H 3.207945 -0.062004 1.783447
H 1.792770 3.126289 0.750791
H 2.152883 2.639834 -0.906805
H -0.433279 3.203671 -0.550330
H -1.160707 2.403496 0.844953
H 1.213754 -1.439030 1.468597
H 1.922542 -2.329002 0.124912
H -2.934434 3.119185 -0.735357
H -2.154950 2.280516 -2.076405
H 4.284823 2.011363 -0.140486
H 3.806255 2.179057 1.541955
H -2.474088 -2.497137 -0.639825
H -3.953852 -1.696445 -1.156032
H -2.783234 1.162311 1.511261
H -4.272877 1.899853 0.942048
H 2.940606 0.607424 -1.954586
H 2.932013 -1.158806 -1.838575
H 1.441690 -0.291150 -2.183347
H -1.401017 0.353719 -2.827427
H -1.472595 -1.405224 -2.659947
H -2.940514 -0.488654 -3.012113
H 4.882816 -0.314528 -0.831128
H -4.153591 -2.421667 1.207038
H -2.702866 -1.533089 1.665248
H -5.377277 -0.310084 0.685663
H 3.847536 -2.529939 -0.025771
H 5.597900 -2.474953 0.247482
H 4.485971 -2.235682 1.594843
H 5.769531 -0.039906 1.847196
H -5.106853 -0.839515 2.978655


%chk=000193426-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193426

0 1
O -0.285855 -2.471678 -1.179544
O 5.801087 0.082121 1.243251
O -4.678042 -0.151443 2.751598
C 1.217083 1.079905 0.138372
C -0.123963 1.071350 -0.623781
C 2.129933 -0.156491 -0.159858
C -0.916827 -0.249579 -0.271931
C -2.327981 -0.328969 -0.955558
C -3.146086 0.960600 -0.566896
C 3.390392 0.212110 0.703336
C 2.166750 2.289765 -0.029764
C -0.979785 2.316738 -0.285963
C 1.343111 -1.424032 0.283497
C -2.383742 2.260827 -0.928656
C 3.542043 1.764589 0.500263
C -0.000359 -1.475881 -0.457874
C -3.138505 -1.580534 -0.482760
C -3.589257 0.976700 0.923327
C 2.500893 -0.276697 -1.662434
C -2.201267 -0.424068 -2.502225
C 4.717779 -0.531548 0.428909
C -3.548941 -1.551803 1.007192
C -4.367881 -0.284559 1.312699
C 4.683458 -2.051050 0.671809
H 0.966801 1.018460 1.224169
H 0.082601 1.083952 -1.713275
H -1.070984 -0.190195 0.829978
H -4.073917 0.930080 -1.180016
H 3.118830 0.019145 1.767220
H 1.815651 3.174675 0.529362
H 2.235234 2.586317 -1.094185
H -0.449228 3.225730 -0.629368
H -1.069096 2.404154 0.816486
H 1.157769 -1.369595 1.376577
H 1.881389 -2.361574 0.066156
H -2.977671 3.138488 -0.604203
H -2.283371 2.340537 -2.028542
H 4.360572 1.973462 -0.211981
H 3.829437 2.255631 1.445474
H -2.567752 -2.496286 -0.710042
H -4.061989 -1.622268 -1.098989
H -2.724483 1.061364 1.608731
H -4.222857 1.865298 1.107423
H 3.052851 0.610433 -2.019566
H 3.136735 -1.163564 -1.837133
H 1.607218 -0.399771 -2.299742
H -1.599435 0.393796 -2.935703
H -1.734951 -1.381241 -2.789449
H -3.205867 -0.374682 -2.964882
H 5.052825 -0.324086 -0.603126
H -4.143275 -2.458962 1.242428
H -2.662583 -1.571462 1.671757
H -5.316248 -0.326441 0.727885
H 4.062066 -2.571517 -0.078455
H 5.708237 -2.456830 0.608013
H 4.274752 -2.288603 1.673716
H 5.579150 -0.056998 2.200512
H -5.147751 -0.971522 3.050667


