%chk=000247418.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247418

0 1
O -0.000095 -1.028675 0.000084
O 0.718614 0.466465 -1.651630
O -0.718590 0.466683 1.651685
C 1.124692 -0.240623 -0.431405
C -1.124766 -0.240416 0.431513
C 1.479496 0.757673 0.636827
C -1.479408 0.757871 -0.636780
C -0.530625 1.045839 -1.633673
C 0.530744 1.045864 1.633691
C 2.204162 -1.211190 -0.840242
C -2.204381 -1.210837 0.840315
C 2.725247 1.394154 0.690171
C -2.725053 1.394570 -0.690118
C -0.811079 1.924587 -2.693644
C 0.811312 1.924644 2.693598
C 3.021728 2.283696 1.729411
C -3.021386 2.284130 -1.729376
C 2.430898 -2.349937 -0.054832
C -2.431987 -2.348929 0.054198
C 2.977999 -0.970288 -1.983403
C -2.977471 -0.970493 1.984091
C -2.059428 2.536105 -2.729423
C 2.059769 2.535951 2.729377
C 3.443877 -3.243813 -0.412279
C -3.445077 -3.242701 0.411576
C 3.989596 -1.868418 -2.333250
C -3.989194 -1.868513 2.333864
C 4.348717 2.968010 1.792656
C -4.348483 2.968194 -1.793036
C 4.223880 -3.002538 -1.548096
C -4.224338 -3.001976 1.548022
H 3.464250 1.184480 -0.084909
H -3.464075 1.185028 0.084980
H -0.056893 2.111330 -3.454118
H 0.057133 2.111582 3.454033
H 1.808612 -2.533700 0.823877
H -1.810275 -2.532277 -0.824999
H 2.777525 -0.090710 -2.598739
H -2.776348 -0.091419 2.599941
H -2.296757 3.224160 -3.541462
H 2.297154 3.224076 3.541339
H 3.623101 -4.129670 0.194695
H -3.624971 -4.128052 -0.195938
H 4.592805 -1.686036 -3.220776
H -4.591828 -1.686556 3.221869
H 4.867387 2.749276 2.736824
H 4.237094 4.059567 1.723637
H 5.021550 2.662910 0.980651
H -5.016049 2.674423 -0.972553
H -4.873178 2.736557 -2.730823
H -4.236460 4.060549 -1.739690
H 5.013092 -3.700426 -1.823553
H -5.013640 -3.699783 1.823425


%chk=000247418-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247418

0 1
O -0.000129 -1.169520 -0.000016
O 0.721122 0.337145 -1.736459
O -0.721130 0.337237 1.736462
C 1.119634 -0.329128 -0.466661
C -1.119751 -0.328942 0.466653
C 1.441404 0.724658 0.599386
C -1.441351 0.724902 -0.599386
C -0.527716 0.985631 -1.649574
C 0.527819 0.985514 1.649597
C 2.272084 -1.268070 -0.786702
C -2.272342 -1.267722 0.786666
C 2.673899 1.421016 0.582583
C -2.673666 1.421596 -0.582481
C -0.852321 1.897093 -2.677358
C 0.852675 1.896737 2.677505
C 3.016329 2.353926 1.585899
C -3.015924 2.354583 -1.585772
C 2.668282 -2.212452 0.191433
C -2.668799 -2.211878 -0.191583
C 2.962464 -1.198388 -2.018098
C -2.962567 -1.198145 2.018154
C -2.085437 2.572138 -2.640369
C 2.085977 2.571471 2.640605
C 3.748013 -3.083454 -0.063701
C -3.748629 -3.082764 0.063529
C 4.046827 -2.070066 -2.268923
C -4.047033 -2.069703 2.268957
C 4.339310 3.099585 1.554345
C -4.339233 3.099682 -1.554904
C 4.443322 -3.013538 -1.294479
C -4.443782 -3.012952 1.294401
H 3.383070 1.208891 -0.225917
H -3.382822 1.209662 0.226081
H -0.128933 2.069207 -3.480092
H 0.129430 2.068776 3.480383
H 2.121647 -2.268826 1.138305
H -2.122282 -2.268178 -1.138528
H 2.640373 -0.476571 -2.773059
H -2.640276 -0.476507 2.773200
H -2.332437 3.283477 -3.437894
H 2.333232 3.282506 3.438320
H 4.046071 -3.816505 0.694046
H -4.046881 -3.815645 -0.694305
H 4.577568 -2.014027 -3.225957
H -4.577654 -2.013748 3.226062
H 4.921339 2.929342 2.479576
H 4.184473 4.191643 1.464109
H 4.963414 2.779522 0.702541
H -4.957775 2.789516 -0.695417
H -4.927004 2.917569 -2.474297
H -4.184769 4.192844 -1.479168
H 5.282907 -3.689708 -1.491589
H -5.283444 -3.689032 1.491496


