%chk=000243248.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243248

0 1
O 4.594500 0.279114 -0.921927
O 4.505788 1.022192 1.181351
C -1.636355 -1.243086 0.095568
C -2.849147 1.155645 -0.117504
C -2.588532 -0.160383 0.669253
C -0.180696 -0.764778 0.088018
C -1.675685 -2.467046 1.046917
C -2.110743 -1.712494 -1.287751
C -3.517785 2.144864 0.869324
C -3.820900 0.923977 -1.291350
C -1.556788 1.794032 -0.646667
C 0.358620 -0.185117 1.254934
C 0.655907 -0.929527 -1.027257
C 1.686504 0.226192 1.303205
C 1.989419 -0.519121 -0.988456
C 2.511417 0.061591 0.175864
C 3.911632 0.508440 0.258950
H -3.572009 -0.640290 0.848521
H -2.216866 0.115524 1.677916
H -1.403877 -2.201576 2.073270
H -0.978638 -3.245901 0.717890
H -2.673666 -2.915714 1.077832
H -1.494293 -2.527924 -1.680070
H -3.141469 -2.083820 -1.239990
H -2.101689 -0.891005 -2.018205
H -2.857689 2.387827 1.707206
H -4.446516 1.740114 1.281197
H -3.767336 3.088795 0.374068
H -4.730761 0.409899 -0.969772
H -4.123883 1.872184 -1.747272
H -3.358483 0.320155 -2.081882
H -1.753762 2.766605 -1.109659
H -0.828597 1.957777 0.155038
H -1.072607 1.169721 -1.404578
H -0.275524 -0.050839 2.132219
H 0.275956 -1.382549 -1.942384
H 2.099111 0.676785 2.210164
H 2.634531 -0.648133 -1.862078
H 5.540611 0.579570 -0.868402


%chk=000243248-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243248

0 1
O 4.762828 0.235590 -0.909049
O 4.612368 0.912790 1.306598
C -1.600631 -1.228510 0.078366
C -2.940557 1.184413 -0.151213
C -2.578751 -0.126236 0.636424
C -0.123813 -0.764403 0.086952
C -1.696895 -2.438255 1.070061
C -2.046798 -1.747141 -1.312220
C -3.589812 2.146841 0.888135
C -3.994257 0.926461 -1.266039
C -1.703212 1.890631 -0.763674
C 0.452611 -0.233689 1.277490
C 0.725636 -0.903097 -1.043229
C 1.802654 0.150448 1.334117
C 2.082006 -0.522241 -0.999580
C 2.633044 0.012098 0.190868
C 4.052075 0.430840 0.290496
H -3.537385 -0.642562 0.857253
H -2.181362 0.188257 1.622459
H -1.473100 -2.132073 2.107891
H -0.982838 -3.233659 0.788996
H -2.717259 -2.864740 1.052139
H -1.488372 -2.660280 -1.591473
H -3.119775 -2.007795 -1.286662
H -1.901266 -1.001270 -2.112499
H -2.865265 2.430262 1.674893
H -4.461127 1.673915 1.381037
H -3.939646 3.074709 0.397716
H -4.885244 0.411404 -0.858331
H -4.329652 1.888674 -1.698303
H -3.595230 0.314611 -2.091535
H -2.006591 2.850886 -1.223155
H -0.938140 2.107087 0.003810
H -1.224267 1.279069 -1.548475
H -0.161745 -0.120753 2.177402
H 0.330225 -1.313280 -1.976526
H 2.237602 0.559403 2.252271
H 2.721135 -0.633195 -1.880297
H 5.700505 0.536493 -0.769612


