%chk=000268169.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268169

0 1
O -0.167336 0.246689 0.313931
O 0.235402 0.102134 2.533296
O 6.017153 -0.833217 -0.024205
C -1.600840 0.452472 0.590723
C -2.086195 1.443474 -0.440238
C -2.251067 -0.910099 0.518135
C -3.360330 2.010065 -0.275644
C -2.266305 -1.706714 1.674423
C -1.296507 1.807374 -1.537646
C -2.813975 -1.395296 -0.669108
C 0.666530 0.056548 1.400327
C 2.049498 -0.178119 0.955861
C -3.835513 2.935608 -1.207052
C -2.855416 -2.972181 1.643248
C -1.776276 2.737311 -2.465206
C -3.403748 -2.663059 -0.695320
C -3.044591 3.301506 -2.302259
C -3.427455 -3.450927 0.459158
C 3.066674 -0.212438 1.935706
C 2.366566 -0.374174 -0.396727
C 4.383575 -0.433263 1.567483
C 3.685795 -0.599622 -0.789718
C 4.682200 -0.625770 0.198182
C 6.461178 -1.047713 -1.388101
H -1.686286 0.889725 1.620470
H -3.980098 1.725986 0.573826
H -1.803977 -1.337933 2.594319
H -0.305777 1.366475 -1.658246
H -2.793333 -0.785984 -1.573150
H -4.823803 3.374332 -1.079270
H -2.866726 -3.587228 2.541514
H -1.158536 3.021715 -3.315205
H -3.843559 -3.036033 -1.618421
H -3.417042 4.025093 -3.024689
H -3.887851 -4.436879 0.437098
H 2.799408 -0.063272 2.987266
H 1.567108 -0.351760 -1.144403
H 5.187866 -0.463583 2.299984
H 3.920619 -0.751503 -1.837581
H 6.248795 -0.165938 -1.999280
H 6.003827 -1.952783 -1.797955
H 7.542951 -1.180618 -1.250826


%chk=000268169-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268169

0 1
O -0.128889 0.268132 0.204439
O 0.335416 0.163164 2.496412
O 6.151709 -1.020453 -0.082756
C -1.586468 0.482299 0.522097
C -2.132677 1.477058 -0.499863
C -2.277041 -0.875828 0.563514
C -3.535970 1.605684 -0.667003
C -2.560752 -1.478466 1.813635
C -1.275054 2.339859 -1.224855
C -2.600856 -1.570046 -0.630062
C 0.727591 0.082490 1.303474
C 2.120271 -0.201840 0.876458
C -4.069147 2.576675 -1.542112
C -3.167389 -2.753427 1.872704
C -1.809262 3.307409 -2.106075
C -3.200649 -2.845743 -0.572504
C -3.207623 3.432004 -2.267670
C -3.488103 -3.440428 0.679635
C 3.120066 -0.342596 1.879690
C 2.482795 -0.341493 -0.486629
C 4.448999 -0.613122 1.528100
C 3.815440 -0.615114 -0.853157
C 4.802482 -0.750294 0.158649
C 6.582499 -1.176741 -1.476518
H -1.620401 0.929951 1.534901
H -4.211022 0.942869 -0.113686
H -2.286789 -0.953611 2.736092
H -0.192688 2.244228 -1.100086
H -2.383874 -1.106234 -1.599065
H -5.155297 2.664027 -1.658682
H -3.383945 -3.210304 2.844690
H -1.132504 3.965161 -2.663409
H -3.445717 -3.376820 -1.499224
H -3.621235 4.183991 -2.949007
H -3.956397 -4.430347 0.723509
H 2.827600 -0.236200 2.929236
H 1.710647 -0.241374 -1.254531
H 5.231464 -0.724276 2.284311
H 4.071828 -0.722273 -1.911005
H 6.407822 -0.249901 -2.055836
H 6.064605 -2.025453 -1.962915
H 7.661116 -1.382215 -1.420195


