%chk=000245510.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245510

0 1
O 4.625098 2.302199 -0.261764
O -4.537136 2.601773 -0.590057
C -0.066819 -2.065290 -0.343157
C -0.092966 -0.755819 0.497763
C 1.219609 -2.878250 -0.081313
C -1.334403 -2.902734 -0.070784
C 1.170682 0.060726 0.304935
C -1.290858 0.127583 0.204260
C 1.392364 -3.356279 1.358005
C -1.542647 -3.999458 -1.112235
C 1.993785 0.333590 1.406301
C -1.874599 0.848344 1.257368
C 1.527432 0.557161 -0.963214
C -1.814342 0.263575 -1.094394
C 3.164634 1.084003 1.260889
C -2.966839 1.690869 1.035242
C 2.686985 1.305592 -1.137997
C -2.902100 1.094643 -1.345936
C 3.493146 1.558061 -0.014703
C -3.464405 1.800605 -0.269454
H -0.060820 -1.783298 -1.426240
H -0.154241 -1.073625 1.573539
H 1.224086 -3.754978 -0.760194
H 2.099613 -2.269366 -0.373334
H -1.277086 -3.352165 0.940221
H -2.225742 -2.243541 -0.053153
H 0.518783 -3.923965 1.701125
H 1.536708 -2.517891 2.047993
H 2.267068 -4.009819 1.451321
H -2.451980 -4.573857 -0.901571
H -0.705030 -4.706771 -1.127690
H -1.643915 -3.586306 -2.121890
H 1.726010 -0.039894 2.394432
H -1.472743 0.758437 2.266704
H 0.885132 0.358658 -1.821638
H -1.367848 -0.294024 -1.919561
H 3.796409 1.290559 2.117441
H -3.411170 2.244976 1.854624
H 2.977915 1.697929 -2.109543
H -3.319469 1.209729 -2.343364
H 5.151916 2.457717 0.558134
H -4.888016 3.083001 0.197089


%chk=000245510-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245510

0 1
O 4.743333 2.362151 -0.226268
O -4.629161 2.736766 -0.577554
C -0.080664 -2.072488 -0.367237
C -0.105247 -0.737856 0.461892
C 1.221877 -2.892136 -0.128935
C -1.365579 -2.904963 -0.100154
C 1.183407 0.085536 0.291214
C -1.336860 0.142110 0.180814
C 1.400152 -3.467863 1.294872
C -1.486279 -4.184515 -0.956544
C 2.037528 0.326383 1.393938
C -1.940663 0.856982 1.244329
C 1.557150 0.632723 -0.966134
C -1.874415 0.325604 -1.121633
C 3.226738 1.079139 1.260340
C -3.033176 1.725735 1.030891
C 2.739255 1.380454 -1.122027
C -2.964003 1.186692 -1.357112
C 3.576936 1.604329 -0.004654
C -3.543189 1.891498 -0.278106
H -0.077617 -1.799951 -1.445832
H -0.160747 -1.028906 1.530963
H 1.245958 -3.726842 -0.856394
H 2.092334 -2.252553 -0.368658
H -1.408697 -3.174705 0.975064
H -2.249158 -2.266453 -0.286750
H 0.580523 -4.157733 1.567024
H 1.438375 -2.668963 2.057850
H 2.347693 -4.033143 1.364351
H -2.465988 -4.671857 -0.797248
H -0.703459 -4.924982 -0.711122
H -1.400653 -3.950703 -2.035265
H 1.773622 -0.079197 2.378569
H -1.546603 0.738408 2.261247
H 0.911553 0.483904 -1.838879
H -1.451227 -0.221132 -1.972023
H 3.870485 1.251588 2.133068
H -3.481115 2.265799 1.875641
H 3.025908 1.802324 -2.090047
H -3.377181 1.323496 -2.360957
H 5.256881 2.468266 0.612553
H -4.955826 3.189454 0.239112


