%chk=000179792.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179792

0 1
O -1.336539 -1.427478 -1.256199
O 1.902320 0.283591 -0.883997
O 2.836373 -1.700289 -0.327541
C -2.129509 -0.206855 0.600428
C -2.407638 -0.508990 -0.893450
C -0.603341 -0.047875 0.611727
C -3.040932 0.937406 1.033884
C -3.792095 -1.117526 -1.062346
C -0.151111 -1.018744 -0.506418
C -4.501652 0.476218 0.842566
C -4.805513 -0.065846 -0.568585
C 0.787668 -0.379882 -1.540757
C 2.891833 -0.495756 -0.318211
C 3.948736 0.438919 0.257753
C 4.043880 0.192336 1.762723
C 5.270236 0.171743 -0.461311
H -2.382652 -1.110111 1.211642
H -2.281106 0.386205 -1.539764
H -0.285484 0.988442 0.405326
H -0.161572 -0.315616 1.583242
H -2.842231 1.851598 0.445455
H -2.861506 1.208859 2.089412
H 0.266812 -1.969650 -0.113129
H -3.881735 -2.061077 -0.492652
H -3.983841 -1.387191 -2.116524
H -5.184404 1.318215 1.062404
H -4.733824 -0.307873 1.589783
H -5.820934 -0.505280 -0.578037
H -4.832562 0.777634 -1.285973
H 0.314968 0.453464 -2.089392
H 1.176432 -1.131666 -2.249646
H 3.633916 1.500250 0.073689
H 4.827485 0.812887 2.213869
H 4.289354 -0.855697 1.986455
H 3.102815 0.427144 2.273826
H 6.073858 0.795975 -0.052802
H 5.199711 0.386966 -1.534541
H 5.584883 -0.876249 -0.355409


%chk=000179792-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179792

0 1
O -1.333623 -1.362339 -1.227288
O 1.986270 0.404719 -0.857446
O 3.078851 -1.654262 -0.710108
C -2.211660 -0.101330 0.590959
C -2.486937 -0.503372 -0.868601
C -0.704251 0.237543 0.532881
C -3.236077 0.950222 1.051240
C -3.839879 -1.192024 -1.028302
C -0.153658 -0.821492 -0.472345
C -4.662495 0.349396 0.890711
C -4.930890 -0.192610 -0.541414
C 0.823533 -0.262728 -1.519488
C 3.059920 -0.421051 -0.492953
C 4.152749 0.381837 0.207182
C 4.092892 0.084064 1.731452
C 5.537217 0.017775 -0.379843
H -2.341334 -1.014932 1.209192
H -2.468194 0.412854 -1.506223
H -0.547290 1.262079 0.143639
H -0.204357 0.168939 1.513346
H -3.138823 1.867024 0.433484
H -3.063621 1.248370 2.103191
H 0.308368 -1.681010 0.045781
H -3.855720 -2.115745 -0.418120
H -4.021088 -1.482177 -2.079658
H -5.425877 1.108746 1.147783
H -4.779253 -0.480700 1.617558
H -5.923388 -0.680725 -0.574432
H -4.974773 0.661681 -1.248498
H 0.348839 0.536488 -2.110746
H 1.191525 -1.070394 -2.174384
H 3.940141 1.453025 0.042629
H 4.868502 0.669045 2.257460
H 4.276003 -0.988484 1.921718
H 3.109866 0.353474 2.158379
H 6.332579 0.560468 0.161983
H 5.606582 0.282466 -1.450160
H 5.720447 -1.066637 -0.283059


