%chk=000193042.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193042

0 1
O 0.519853 2.127617 2.367272
O -0.368872 -2.237977 2.043237
O 6.301313 1.269589 -1.440992
O -6.198686 -1.343967 -1.470724
O 7.219424 -0.395880 0.025434
O -7.237339 0.330124 -0.093397
C 0.743358 0.208357 0.741853
C -0.774957 -0.142256 0.708051
C 1.495517 -0.206927 -0.560073
C -1.517374 0.408231 -0.552001
C 1.007804 1.701324 1.044367
C -1.013438 -1.665261 0.849978
C 3.008894 -0.288062 -0.382553
C -3.035595 0.422808 -0.414023
C 3.875456 0.612338 -1.084481
C -3.834410 -0.554316 -1.080549
C 3.565320 -1.270122 0.483349
C -3.664252 1.408217 0.391996
C 5.262593 0.477156 -0.881602
C -5.217689 -0.497658 -0.895161
C 4.975626 -1.395962 0.683382
C -5.073928 1.458945 0.571141
C 5.801891 -0.501510 -0.020555
C -5.827138 0.483637 -0.086377
C 7.564951 0.610684 -1.012713
C -7.495827 -0.898444 -0.891954
H 1.173463 -0.369670 1.583086
H -1.245243 0.329585 1.602063
H 1.120611 -1.195815 -0.888580
H 1.253023 0.505791 -1.372988
H -1.161485 1.438642 -0.747810
H -1.226493 -0.196276 -1.432554
H 2.094558 1.878600 1.090057
H 0.586554 2.350744 0.244413
H -0.558259 -2.218145 0.009460
H -2.101721 -1.878001 0.853051
H 3.475537 1.377220 -1.756651
H -3.382002 -1.318069 -1.719939
H 2.892610 -1.956670 1.010791
H -3.046882 2.171259 0.881860
H -0.469993 2.113514 2.371350
H -0.762568 -1.822436 2.851893
H 5.394946 -2.152306 1.351547
H -5.549436 2.227647 1.185404
H 8.231981 1.367635 -0.571320
H 8.012874 0.093331 -1.882372
H -7.881034 -1.689338 -0.223003
H -8.189031 -0.653633 -1.713063


%chk=000193042-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193042

0 1
O 0.508622 2.125805 2.366924
O -0.363891 -2.247761 2.011769
O 6.292911 1.275153 -1.409333
O -6.192582 -1.337670 -1.478723
O 7.202198 -0.401803 0.046745
O -7.234982 0.338577 -0.111274
C 0.744088 0.211442 0.737575
C -0.774132 -0.138689 0.698520
C 1.499904 -0.198568 -0.563995
C -1.514451 0.423233 -0.557880
C 1.008614 1.702959 1.047353
C -1.013057 -1.662864 0.826872
C 3.011839 -0.283649 -0.381033
C -3.032805 0.436092 -0.422699
C 3.877193 0.616977 -1.069364
C -3.828797 -0.545986 -1.085087
C 3.562366 -1.271557 0.478029
C -3.664370 1.424128 0.377721
C 5.251823 0.477513 -0.863613
C -5.211709 -0.493175 -0.898885
C 4.962494 -1.400653 0.681676
C -5.074024 1.472210 0.556216
C 5.785707 -0.507852 -0.008901
C -5.824108 0.490519 -0.094685
C 7.550624 0.594702 -0.999491
C -7.479438 -0.926633 -0.854256
H 1.171806 -0.370601 1.577219
H -1.245078 0.325606 1.595994
H 1.124568 -1.185117 -0.898664
H 1.261698 0.518558 -1.374314
H -1.158687 1.455635 -0.742946
H -1.221327 -0.172731 -1.443556
H 2.095262 1.877683 1.104004
H 0.596568 2.355740 0.245405
H -0.562297 -2.208157 -0.021000
H -2.101428 -1.874861 0.832958
H 3.481525 1.388268 -1.736791
H -3.374305 -1.310455 -1.722175
H 2.887100 -1.961592 0.997610
H -3.049103 2.190998 0.864276
H -0.481357 2.121927 2.358791
H -0.752236 -1.838214 2.826081
H 5.378423 -2.162282 1.345982
H -5.551714 2.243995 1.164916
H 8.238180 1.340000 -0.571120
H 7.974317 0.065904 -1.874799
H -7.798256 -1.708969 -0.140310
H -8.219190 -0.739489 -1.648140


