%chk=000268728.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268728

0 1
O -1.646765 0.377533 -0.291229
O 2.190964 -0.310456 0.524925
O -2.335454 0.358512 1.886537
O 0.538527 -0.419847 -1.042137
C 0.031347 0.042934 1.354668
C 0.561487 1.321364 2.049367
C 0.146525 -1.169990 2.311099
C -1.462283 0.270192 1.060938
C 0.856957 -0.248468 0.096171
C 0.458012 2.549855 1.185464
C -0.306258 -2.461615 1.684210
C -0.673803 3.374291 1.265852
C 0.621362 -3.290115 1.035336
C 1.500158 2.879450 0.306241
C -1.652938 -2.846469 1.758574
C -0.759272 4.520871 0.471444
C 0.202298 -4.496167 0.467672
C 1.408889 4.026884 -0.485556
C -2.066113 -4.053268 1.188283
C 0.280732 4.849722 -0.403843
C -1.140444 -4.880199 0.543621
C -2.893431 0.593668 -0.905979
C 3.257958 -0.597589 -0.334122
C -2.792720 0.511355 -2.304665
C 4.489813 -0.144003 0.163996
C -4.086122 0.873949 -0.241870
C 3.140670 -1.312065 -1.527810
C -3.947150 0.725850 -3.054072
C 5.639501 -0.431671 -0.571556
C -5.229495 1.083254 -1.023327
C 4.310655 -1.581091 -2.245871
C -5.164071 1.011509 -2.416813
C 5.552958 -1.147249 -1.773201
H 1.622086 1.152263 2.345345
H 0.010248 1.472711 3.003497
H -0.445358 -0.963964 3.231217
H 1.202805 -1.257728 2.651280
H -1.490482 3.121274 1.941644
H 1.668004 -2.993011 0.969087
H 2.378275 2.236460 0.235070
H -2.379940 -2.201905 2.255639
H -1.640987 5.157270 0.532907
H 0.924032 -5.136858 -0.036764
H 2.217544 4.277928 -1.170499
H -3.113178 -4.347924 1.244676
H 0.210707 5.741959 -1.022906
H -1.464956 -5.819210 0.099544
H -1.830071 0.284920 -2.763929
H 4.531688 0.408556 1.098725
H -4.133953 0.924962 0.847118
H 2.167185 -1.637509 -1.898781
H -3.903237 0.670038 -4.141450
H 6.610348 -0.094802 -0.208446
H -6.177170 1.303804 -0.532459
H 4.247218 -2.134585 -3.183087
H -6.059062 1.176477 -3.012663
H 6.455958 -1.363753 -2.340215


%chk=000268728-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268728

0 1
O -1.694956 0.686216 -0.374074
O 2.137724 -0.339805 0.400562
O -2.527832 -0.168791 1.641329
O 0.392671 -1.024426 -1.013447
C -0.093256 -0.096447 1.252205
C 0.392038 1.253590 1.927553
C 0.033669 -1.224832 2.353128
C -1.575634 0.089936 0.869150
C 0.772563 -0.518034 0.052746
C 0.243669 2.525303 1.105449
C -0.145762 -2.658021 1.869748
C -0.880561 3.370535 1.288862
C 0.984466 -3.443841 1.523364
C 1.226406 2.901711 0.153573
C -1.435134 -3.243321 1.775124
C -1.028402 4.555714 0.534881
C 0.832949 -4.778504 1.085737
C 1.082771 4.086142 -0.602318
C -1.589125 -4.577024 1.335984
C -0.046391 4.917195 -0.416044
C -0.456704 -5.349558 0.988261
C -2.917843 1.064254 -1.012822
C 3.223021 -0.751181 -0.438477
C -2.712703 1.618679 -2.295251
C 4.409994 -0.009713 -0.251213
C -4.212940 0.923323 -0.462188
C 3.168085 -1.847326 -1.329204
C -3.826074 2.041710 -3.049039
C 5.567551 -0.364102 -0.976588
C -5.315838 1.354632 -1.236603
C 4.337787 -2.185488 -2.047882
C -5.133608 1.911308 -2.522157
C 5.534647 -1.452348 -1.880107
H 1.449833 1.094689 2.199306
H -0.185708 1.345765 2.866838
H -0.724955 -0.985380 3.119953
H 1.034121 -1.106991 2.806585
H -1.645368 3.097804 2.027577
H 1.989933 -3.012494 1.610343
H 2.104238 2.262918 0.003625
H -2.313635 -2.648060 2.047490
H -1.905418 5.194299 0.688634
H 1.717864 -5.371703 0.828095
H 1.851649 4.362120 -1.333022
H -2.591666 -5.014705 1.269445
H -0.157779 5.836723 -1.001570
H -0.577624 -6.385213 0.651013
H -1.690373 1.704808 -2.674212
H 4.414881 0.823533 0.458599
H -4.352895 0.491588 0.528737
H 2.243733 -2.409147 -1.469760
H -3.672374 2.470353 -4.045098
H 6.490722 0.207869 -0.834351
H -6.325197 1.249637 -0.823404
H 4.305984 -3.030119 -2.744719
H -5.999003 2.238561 -3.108349
H 6.431985 -1.726034 -2.445098


