%chk=000296710.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296710

0 1
O -0.002616 0.005041 -0.854996
O -2.299479 0.061070 1.896793
O 2.291624 -0.076996 1.898466
C -0.564986 -0.513763 0.393893
C 0.558428 0.511794 0.399405
C -0.303418 -1.951618 0.680364
C 0.296608 1.946842 0.699397
C -1.990688 -0.059162 0.732213
C 1.983776 0.053894 0.734795
C -0.550591 -2.456714 1.965326
C 0.542610 2.439629 1.989354
C 0.192032 -2.791002 -0.327796
C -0.197932 2.795831 -0.301134
C -2.936144 0.190542 -0.385816
C 2.930011 -0.185887 -0.384755
C -0.304663 -3.804997 2.235889
C 0.296436 3.785263 2.272571
C 0.432107 -4.138597 -0.049834
C -0.438264 4.140710 -0.010520
C -2.699488 -0.268974 -1.689534
C 2.695066 0.286840 -1.684063
C -4.116163 0.900451 -0.098992
C 4.108923 -0.899977 -0.103918
C 0.184102 -4.645934 1.230349
C -0.191420 4.635781 1.274676
C -3.634858 -0.018808 -2.697363
C 3.631069 0.045624 -2.693469
C -5.044999 1.152480 -1.109672
C 5.038393 -1.143049 -1.116229
C -4.804571 0.691805 -2.409131
C 4.799698 -0.669197 -2.411248
H -0.934309 -1.793867 2.746756
H 0.925619 1.769336 2.764760
H 0.395095 -2.381766 -1.318931
H -0.400094 2.396101 -1.296323
H -0.492964 -4.199298 3.233640
H 0.483824 4.170006 3.274217
H 0.815775 -4.793268 -0.830476
H -0.821230 4.802811 -0.785217
H -1.784042 -0.819465 -1.922838
H 1.780446 0.840651 -1.912674
H -4.296280 1.248168 0.922441
H 4.287736 -1.258016 0.914166
H 0.373761 -5.696526 1.445002
H -0.381272 5.684272 1.499197
H -3.450702 -0.378024 -3.708554
H 3.448278 0.415087 -3.701209
H -5.956542 1.704311 -0.885778
H 5.949078 -1.698155 -0.896990
H -5.531130 0.886551 -3.197874
H 5.526747 -0.856931 -3.201238


%chk=000296710-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296710

0 1
O -0.002427 0.006427 -1.009362
O -2.162675 0.406556 1.889863
O 2.154885 -0.421588 1.888341
C -0.597941 -0.478732 0.295722
C 0.591752 0.478598 0.301068
C -0.427753 -1.952591 0.578765
C 0.421253 1.949629 0.598346
C -1.970512 0.093155 0.678463
C 1.963811 -0.097226 0.679660
C -0.871246 -2.500574 1.809750
C 0.862959 2.485640 1.835225
C 0.175795 -2.795164 -0.388038
C -0.181089 2.801455 -0.361059
C -3.047144 0.197857 -0.349911
C 3.041088 -0.193482 -0.348845
C -0.709787 -3.878876 2.065649
C 0.701061 3.861403 2.104222
C 0.331575 -4.173959 -0.126787
C -0.337293 4.177652 -0.086713
C -2.915763 -0.349423 -1.655733
C 2.911659 0.367016 -1.649250
C -4.260886 0.841667 0.020586
C 4.253396 -0.843127 0.016112
C -0.110874 -4.720831 1.099459
C 0.103471 4.712640 1.145364
C -3.986456 -0.256527 -2.569685
C 3.982821 0.281187 -2.563343
C -5.322529 0.941551 -0.897614
C 5.315478 -0.935934 -0.902327
C -5.187977 0.390234 -2.196202
C 5.182843 -0.371557 -2.195495
H -1.324316 -1.847807 2.562792
H 1.314915 1.825577 2.582553
H 0.519216 -2.361581 -1.333149
H -0.523304 2.376920 -1.310700
H -1.047534 -4.294819 3.021297
H 1.037394 4.268093 3.064340
H 0.798482 -4.819353 -0.879254
H -0.803227 4.830293 -0.833513
H -1.986596 -0.841651 -1.954536
H 1.983646 0.863984 -1.943773
H -4.342155 1.250194 1.033499
H 4.333227 -1.261807 1.024988
H 0.010989 -5.790904 1.301535
H -0.018720 5.780705 1.357611
H -3.885449 -0.684731 -3.572827
H 3.883333 0.719541 -3.562246
H -6.252973 1.442038 -0.608438
H 6.244775 -1.441029 -0.617509
H -6.015315 0.464103 -2.911176
H 6.010513 -0.439940 -2.910630


