%chk=000239802.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239802

0 1
O -4.400211 0.684400 -0.060778
O -0.284124 -1.519319 0.092285
O 1.826451 1.965129 -0.527953
O 3.525285 0.444352 1.889532
C -2.345068 -0.351575 0.006548
C -5.988637 -1.147311 0.318653
C -4.565867 -0.717316 0.176836
C -3.031522 0.883640 -0.160939
C -0.943702 -0.311605 -0.068705
C -3.361586 -1.357321 0.221472
C -0.272943 0.897127 -0.298037
C -2.400554 2.115650 -0.393333
C -1.017444 2.097833 -0.457070
C -6.759059 -0.857487 -0.974217
C -6.631363 -0.454041 1.525034
C 1.205623 0.933163 -0.366950
C 1.840305 -0.406207 -0.219823
C 3.305365 -0.500299 -0.309185
C 1.097266 -1.506717 0.009310
C 4.132372 -0.011113 0.723239
C 3.916272 -1.071203 -1.435814
C 5.529876 -0.073625 0.636977
C 5.308750 -1.142486 -1.527641
C 6.112402 -0.644368 -0.495395
C 3.632538 1.880481 2.084680
H -5.993410 -2.256776 0.498056
H -3.162573 -2.399905 0.383102
H -2.979683 3.026518 -0.514170
H -0.453663 3.021525 -0.634598
H -6.757294 0.215439 -1.208374
H -7.804351 -1.174991 -0.893507
H -6.317129 -1.378022 -1.831746
H -6.097557 -0.685591 2.454126
H -7.674000 -0.764648 1.652929
H -6.624163 0.637957 1.409047
H 1.432377 -2.530992 0.161784
H 3.297619 -1.447492 -2.249924
H 6.139452 0.309576 1.451704
H 5.770067 -1.582656 -2.409556
H 7.197361 -0.702030 -0.575115
H 4.676963 2.168378 2.218418
H 3.053297 2.031821 3.001681
H 3.173862 2.400908 1.231317


%chk=000239802-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239802

0 1
O -4.507864 0.688048 -0.075800
O -0.339249 -1.511903 0.000082
O 1.782788 2.025330 -0.729232
O 3.439430 0.956723 1.563657
C -2.436939 -0.327216 -0.047889
C -6.093029 -1.191588 0.298029
C -4.676065 -0.717190 0.142213
C -3.124820 0.908417 -0.190601
C -1.026135 -0.294001 -0.135613
C -3.445589 -1.347209 0.163966
C -0.343070 0.929024 -0.356370
C -2.496917 2.149695 -0.413380
C -1.095516 2.137253 -0.494752
C -6.922611 -0.927690 -0.989082
C -6.770990 -0.545567 1.538048
C 1.142226 0.959217 -0.461154
C 1.808769 -0.357204 -0.264350
C 3.290495 -0.470302 -0.343877
C 1.053030 -1.485335 -0.059448
C 4.118890 0.260270 0.560175
C 3.911363 -1.277585 -1.325142
C 5.528758 0.212295 0.442459
C 5.319471 -1.351894 -1.434518
C 6.122022 -0.594371 -0.555256
C 4.204848 1.899243 2.381773
H -6.036983 -2.285746 0.460108
H -3.276230 -2.410775 0.312751
H -3.076775 3.069985 -0.517451
H -0.526298 3.055027 -0.670700
H -6.986035 0.155761 -1.192833
H -7.949236 -1.317590 -0.866057
H -6.467756 -1.417238 -1.868496
H -6.207772 -0.762472 2.463072
H -7.797936 -0.936126 1.656054
H -6.828968 0.550807 1.419592
H 1.464215 -2.485169 0.094718
H 3.276533 -1.823582 -2.032601
H 6.165099 0.784236 1.124200
H 5.778893 -1.976143 -2.207600
H 7.214123 -0.628027 -0.639829
H 4.950481 1.374815 3.011433
H 3.459280 2.390444 3.023820
H 4.709670 2.654133 1.749783


