%chk=000228689.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228689

0 1
O -2.966476 -0.438552 1.035725
O -2.528349 1.742236 0.532971
C -2.030780 0.621877 1.290890
C -3.549084 -0.249754 -0.284605
C -3.255645 1.233001 -0.612910
C -0.625922 0.248671 0.881500
C 3.431971 -0.817885 -0.162596
C 2.008838 -0.432850 0.197181
C -2.922683 -1.228599 -1.260430
C 0.248969 1.229341 0.398230
C -0.186467 -1.073585 1.017179
C 1.559423 0.889705 0.058483
C 1.124697 -1.412042 0.676917
C 4.431195 -0.066708 0.726172
C 3.699930 -0.557511 -1.650324
H -2.137194 0.890785 2.359927
H -4.626848 -0.456277 -0.114956
H -2.617538 1.377148 -1.498571
H -4.153844 1.866365 -0.672966
H 3.568591 -1.915708 0.022114
H -3.062933 -2.262420 -0.916468
H -3.355387 -1.145167 -2.262069
H -1.836263 -1.076907 -1.342455
H -0.105712 2.255512 0.284527
H -0.878796 -1.834583 1.381980
H 2.236034 1.655919 -0.315010
H 1.458357 -2.441947 0.787613
H 4.395938 1.015234 0.557494
H 5.457765 -0.395006 0.532195
H 4.221324 -0.237002 1.788597
H 2.970482 -1.078357 -2.280957
H 4.698015 -0.904384 -1.938396
H 3.640889 0.508550 -1.895882


%chk=000228689-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228689

0 1
O -2.925204 -0.479471 1.036303
O -2.532697 1.748245 0.376382
C -1.996012 0.655186 1.204321
C -3.736174 -0.225934 -0.200031
C -3.095630 1.051141 -0.800318
C -0.567694 0.279626 0.810754
C 3.591249 -0.737931 -0.171363
C 2.141769 -0.379191 0.166857
C -3.697598 -1.454564 -1.110262
C 0.363450 1.297845 0.484746
C -0.136988 -1.066783 0.817044
C 1.696678 0.969823 0.164160
C 1.202000 -1.387338 0.496675
C 4.582905 -0.125879 0.854345
C 3.965050 -0.315142 -1.617441
H -2.063485 1.004415 2.249972
H -4.768874 -0.018528 0.140497
H -2.291959 0.791219 -1.518686
H -3.819511 1.737654 -1.263974
H 3.684681 -1.841302 -0.110354
H -4.087100 -2.340024 -0.579542
H -4.322519 -1.290588 -2.008498
H -2.663134 -1.668012 -1.431622
H 0.028627 2.341060 0.468342
H -0.858438 -1.852078 1.065149
H 2.398257 1.773320 -0.091492
H 1.522683 -2.436823 0.503574
H 4.545073 0.979238 0.831524
H 5.620062 -0.433387 0.623928
H 4.344146 -0.450346 1.883090
H 3.283266 -0.772667 -2.356796
H 4.998683 -0.626420 -1.858071
H 3.906936 0.782736 -1.738111


