%chk=000266127.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266127

0 1
O 4.507243 0.937273 -0.100104
O -3.690980 0.203075 0.230066
O 4.261824 -0.051059 -2.114077
O -4.726892 2.233798 0.321421
C 2.374834 2.003278 -0.648411
C 3.894510 2.181130 -0.619923
C 1.786188 1.596884 0.708795
C 0.323070 1.272444 0.585725
C 4.409294 3.231823 0.348104
C -0.079763 0.005419 0.124664
C -0.646489 2.227982 0.920612
C -1.430857 -0.307825 0.001608
C -2.009897 1.937190 0.810099
C -2.375305 0.671174 0.352668
C 4.630282 -0.125831 -0.961073
C 5.251022 -1.287690 -0.279563
C 5.453802 -2.461005 -1.024302
C 5.630385 -1.230317 1.069547
C -4.806794 1.035499 0.218664
C -6.022933 0.202503 0.063207
C 6.035179 -3.574711 -0.414894
C 6.211425 -2.348499 1.672440
C 6.413152 -3.518222 0.931458
C -7.259213 0.863201 -0.038541
C -5.962314 -1.198337 0.018755
C -8.430491 0.118232 -0.184952
C -7.139408 -1.936432 -0.127474
C -8.370469 -1.279622 -0.229328
H 1.899318 2.938203 -1.004771
H 2.121175 1.233271 -1.411017
H 4.289348 2.333104 -1.651441
H 1.947527 2.404784 1.450334
H 2.347536 0.722978 1.105498
H 4.228121 2.939860 1.391658
H 5.493117 3.371407 0.244857
H 3.923694 4.199996 0.181314
H 0.671723 -0.737527 -0.143367
H -0.342427 3.213711 1.271756
H -1.761501 -1.280413 -0.354801
H -2.762565 2.686440 1.065057
H 5.154478 -2.490810 -2.075731
H 5.468720 -0.310264 1.637069
H 6.194401 -4.486605 -0.988689
H 6.507525 -2.308610 2.719574
H 6.866925 -4.389199 1.404637
H -7.293158 1.955644 -0.001851
H -4.994915 -1.701715 0.098769
H -9.390935 0.626034 -0.264561
H -7.096888 -3.024286 -0.162314
H -9.287328 -1.858656 -0.343773


%chk=000266127-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266127

0 1
O 4.597049 0.871403 -0.082772
O -3.836498 0.252377 0.187145
O 4.533271 -0.219923 -2.147292
O -4.982871 2.178447 0.912458
C 2.392034 1.839981 -0.706766
C 3.917746 2.070535 -0.696381
C 1.755755 1.631886 0.694532
C 0.272759 1.304469 0.601237
C 4.398017 3.271028 0.122585
C -0.160141 0.030125 0.145462
C -0.717334 2.259832 0.935362
C -1.529133 -0.272294 0.026860
C -2.100049 1.983281 0.825240
C -2.492986 0.705412 0.364653
C 4.843493 -0.214529 -0.928031
C 5.513294 -1.341660 -0.213051
C 5.821582 -2.511330 -0.955692
C 5.840011 -1.272246 1.166467
C -4.992396 1.007109 0.465523
C -6.221893 0.221304 0.156188
C 6.451612 -3.602739 -0.323751
C 6.470475 -2.367179 1.794445
C 6.776928 -3.532840 1.052324
C -7.475793 0.842731 0.398100
C -6.176380 -1.099240 -0.363188
C -8.672079 0.150136 0.124039
C -7.376869 -1.787707 -0.636553
C -8.625236 -1.166348 -0.394247
H 1.919420 2.712619 -1.200455
H 2.176760 0.964130 -1.346386
H 4.270032 2.135558 -1.743274
H 1.895540 2.542297 1.306255
H 2.298754 0.812604 1.204070
H 4.162055 3.148851 1.193304
H 5.489715 3.395572 0.024259
H 3.908111 4.192778 -0.240609
H 0.581899 -0.734852 -0.113504
H -0.408760 3.249221 1.294602
H -1.867959 -1.253095 -0.320411
H -2.846392 2.731792 1.090880
H 5.560138 -2.540511 -2.018693
H 5.598913 -0.364747 1.726839
H 6.689362 -4.504407 -0.898378
H 6.723251 -2.314093 2.858970
H 7.266654 -4.381458 1.543164
H -7.486667 1.862006 0.798019
H -5.206466 -1.568600 -0.546351
H -9.637533 0.631914 0.311970
H -7.341401 -2.806359 -1.037631
H -9.555499 -1.704538 -0.608135


