%chk=000228312.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228312

0 1
O -0.510151 0.124408 2.132748
C -0.998833 -0.112185 -0.271754
C 1.413693 0.010682 0.654126
C -0.057503 0.468549 0.811300
C -0.903621 -1.649158 -0.277897
C 1.479445 -1.527946 0.588946
C 0.544282 -2.115694 -0.473766
C -2.453437 0.381656 -0.045734
C 2.102329 0.678332 -0.565380
C -2.532862 1.911212 -0.163710
C -3.434072 -0.257145 -1.037974
C 1.974447 2.207422 -0.520344
C 3.588046 0.294565 -0.629927
H -0.647510 0.265751 -1.262664
H 1.952219 0.337773 1.579494
H -0.128244 1.582243 0.846084
H -1.536693 -2.065200 -1.084656
H -1.312360 -2.056702 0.666172
H 1.223060 -1.940564 1.584103
H 2.520293 -1.852701 0.392314
H 0.589249 -3.220619 -0.442854
H 0.897235 -1.826683 -1.483150
H -2.754673 0.094984 0.994032
H 1.602930 0.309556 -1.495754
H -2.219584 2.261843 -1.151637
H -3.556358 2.265392 0.000735
H -1.900545 2.402475 0.586291
H -3.136416 -0.074295 -2.075761
H -4.442487 0.152783 -0.911595
H -3.507928 -1.340344 -0.897942
H 2.382037 2.620605 0.409049
H 2.519868 2.673224 -1.348450
H 0.931153 2.532715 -0.597256
H 4.137145 0.655342 0.246462
H 4.068894 0.722116 -1.515872
H 3.720341 -0.792931 -0.676628
H -0.567188 -0.846060 2.236348


%chk=000228312-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228312

0 1
O -0.506525 0.143252 2.209857
C -1.015229 -0.126964 -0.235349
C 1.430841 0.003556 0.636775
C -0.046465 0.459220 0.833631
C -0.907500 -1.678074 -0.252774
C 1.488121 -1.551286 0.640640
C 0.549995 -2.171846 -0.420638
C -2.485243 0.369139 -0.047111
C 2.122186 0.640976 -0.616964
C -2.576403 1.913858 0.023773
C -3.416659 -0.153718 -1.169825
C 1.921848 2.177146 -0.685085
C 3.640606 0.329489 -0.633588
H -0.663895 0.247838 -1.223618
H 1.983423 0.375752 1.526407
H -0.093108 1.558157 0.824599
H -1.528149 -2.090898 -1.068228
H -1.332894 -2.087405 0.690450
H 1.194261 -1.926509 1.645102
H 2.525267 -1.902797 0.492645
H 0.582988 -3.276900 -0.354716
H 0.907731 -1.907949 -1.436132
H -2.845844 -0.029472 0.924031
H 1.678692 0.203241 -1.535537
H -2.107312 2.382599 -0.864481
H -3.634038 2.235874 0.050831
H -2.087357 2.312539 0.928819
H -3.056434 0.173696 -2.165353
H -4.439965 0.243982 -1.037243
H -3.491641 -1.255448 -1.180515
H 2.232690 2.657667 0.263005
H 2.536131 2.608860 -1.497152
H 0.872345 2.460771 -0.881274
H 4.129191 0.729202 0.276392
H 4.123698 0.801339 -1.509428
H 3.851452 -0.753338 -0.683391
H -0.490605 -0.840148 2.328943


