%chk=000027812.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027812

0 1
 O    4.632300      0.5236000      0.1975000    
 O   -6.111900      0.5597000     -0.6379000    
 C    2.208800      6.9200002E-02  0.4460000    
 C    1.286300     -0.8107000     -0.4361000    
 C  -3.3599999E-02  -1.130200      0.2686000    
 C    3.438000      0.1943000     -0.5000000    
 C    2.204900      -1.932900     -0.8995000    
 C    3.571800      -1.238700      -1.087700    
 C    2.629000     -0.5892000       1.789200    
 C  -0.7737000      0.1946000      0.5516000    
 C    1.439400       1.312000      0.8207000    
 C  -0.8838000      -2.121600     -0.5325000    
 C   9.4700001E-02   1.337400      0.8785000    
 C   -2.127300      0.2781000      0.4717000    
 C   -2.262300      -2.237800      0.1048000    
 C   -2.944600     -0.8931000      0.1080000    
 C    3.242900       1.178600      -1.583500    
 C    3.462600      0.3649000       2.605100    
 C   -2.942800       1.525300      0.7617000    
 C   -4.238700     -0.8082000     -0.2444000    
 C   -4.062500       1.741000     -0.2478000    
 C   -4.914100      0.5046000     -0.3700000    
 C    3.084300       1.979100      -2.463900    
 H    1.014600     -0.2542000      -1.349900    
 H   0.1663000      -1.606400       1.236500    
 H    1.858200      -2.387200      -1.833400    
 H    2.278900      -2.729300     -0.1510000    
 H    4.348800      -1.815800     -0.5715000    
 H    3.847100      -1.224300      -2.149300    
 H    3.177000      -1.526700       1.646500    
 H    1.745800     -0.8447000       2.386100    
 H    1.979100       2.228800       1.040400    
 H  -0.4031000      -3.106800     -0.5442000    
 H  -0.9777000      -1.797400      -1.577500    
 H  -0.3603000       2.279900       1.160000    
 H   -2.172500      -2.603100       1.135800    
 H   -2.847800      -2.982400     -0.4480000    
 H    4.532600      0.1683000       2.480900    
 H    3.296000       1.432400       2.461400    
 H    3.274200      0.1707000       3.669100    
 H    5.379500      0.4243000     -0.4174000    
 H   -3.376000       1.420200       1.765800    
 H   -2.342500       2.437500      0.7760000    
 H   -4.824200      -1.686000     -0.4966000    
 H   -3.662400       1.984600      -1.238500    
 H   -4.695400       2.571200      8.4299996E-02
 H    2.942800       2.689200      -3.244700    


%chk=000027812-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000027812

0 1
O 4.702640 0.583811 0.234287
O -6.314437 0.583636 -0.193206
C 2.261158 0.053356 0.415612
C 1.350239 -0.857533 -0.468972
C -0.015730 -1.137169 0.185597
C 3.512131 0.161942 -0.539818
C 2.281028 -2.022625 -0.879464
C 3.663826 -1.316385 -1.089349
C 2.693730 -0.639684 1.764508
C -0.728113 0.209092 0.431175
C 1.506674 1.328047 0.707728
C -0.893059 -2.110266 -0.627439
C 0.134075 1.361257 0.723223
C -2.117442 0.316343 0.368091
C -2.282439 -2.224388 0.031541
C -2.955156 -0.862678 0.110594
C 3.298368 1.121217 -1.645397
C 3.214077 0.310989 2.866848
C -2.870255 1.617136 0.651222
C -4.329174 -0.761770 -0.035567
C -4.164902 1.765563 -0.182556
C -5.046113 0.517402 -0.113366
C 3.194460 1.917638 -2.581030
H 1.136287 -0.274981 -1.391443
H 0.156210 -1.611876 1.177464
H 1.931488 -2.528482 -1.795853
H 2.340059 -2.785292 -0.080188
H 4.465111 -1.810548 -0.511566
H 3.962839 -1.312700 -2.151467
H 3.474768 -1.392167 1.552113
H 1.819046 -1.187958 2.163645
H 2.077971 2.233376 0.946773
H -0.410867 -3.104758 -0.673184
H -0.998119 -1.743285 -1.668088
H -0.347787 2.313733 0.969046
H -2.155811 -2.629570 1.058206
H -2.929708 -2.934141 -0.513940
H 4.082808 0.886052 2.509549
H 2.430081 1.017417 3.193706
H 3.525199 -0.275878 3.751193
H 5.422477 0.817202 -0.406231
H -3.143488 1.632368 1.727634
H -2.233599 2.499579 0.475326
H -4.940179 -1.665325 -0.154726
H -3.906386 1.928269 -1.249397
H -4.754707 2.638916 0.145933
H 3.079422 2.617917 -3.387869


