%chk=000227203.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227203

0 1
 O   0.5557000       3.029400      -1.163600    
 O   -3.287000     -0.3341000     -0.5070000    
 O   -3.425800      -1.426200       1.522500    
 C  -0.3351000       2.774700     -6.4400002E-02
 C   0.4850000       2.043400      0.9842000    
 C   -1.538100       1.988400     -0.5483000    
 C    1.843300       2.670700      0.7944000    
 C    1.903700       2.837100     -0.7092000    
 C   -2.475800       1.636200      0.6029000    
 C   -3.706200      0.8842000      0.1156000    
 C    1.089900      -1.976100     -0.6689000    
 C  -0.2807000      -2.178000     -1.8100001E-02
 C    2.206100      -1.687800      0.3395000    
 C   -1.358900      -2.449700      -1.072500    
 C    3.571900      -1.460800     -0.3126000    
 C   -2.744600      -2.625900     -0.4578000    
 C    4.660100      -1.250200      0.7411000    
 C   -3.190100      -1.413100      0.3212000    
 C    6.026500      -1.062100      0.1010000    
 H  -0.6537000       3.751100      0.3216000    
 H   9.7599998E-02   2.167500       1.999200    
 H   0.5389000      0.9735000      0.7611000    
 H   -2.070500       2.575400      -1.307200    
 H   -1.197700       1.081600      -1.064100    
 H    2.665300       2.068100       1.189800    
 H    1.871400       3.652600       1.281500    
 H    2.290900       1.933400      -1.191600    
 H    2.520600       3.687200      -1.013400    
 H   -2.795700       2.551600       1.113900    
 H   -1.949500       1.015600       1.336500    
 H   -4.241100       1.470900     -0.6388000    
 H   -4.410600      0.6995000      0.9349000    
 H    1.031200      -1.142500      -1.380000    
 H    1.351900      -2.869900      -1.248500    
 H  -0.5320000      -1.283800      0.5628000    
 H  -0.2339000      -3.018000      0.6853000    
 H    1.943300     -0.8108000      0.9405000    
 H    2.275700      -2.533200       1.035800    
 H   -1.102700      -3.357200      -1.632300    
 H   -1.376100      -1.625200      -1.795700    
 H    3.826800      -2.326300     -0.9360000    
 H    3.521800     -0.5880000     -0.9747000    
 H   -3.490100      -2.830500      -1.234200    
 H   -2.746600      -3.487100      0.2205000    
 H    4.697300      -2.112500       1.417000    
 H    4.422100     -0.3702000       1.350000    
 H    6.033000     -0.1887000     -0.5589000    
 H    6.308200      -1.940700     -0.4882000    
 H    6.788600     -0.9113000      0.8719000    


%chk=000227203-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227203

0 1
O 0.813811 3.071314 -0.864013
O -3.270191 -0.403013 -0.687969
O -3.722936 -1.181871 1.464250
C -0.274157 2.811164 0.131949
C 0.411536 2.123594 1.343777
C -1.382460 1.987899 -0.544675
C 1.895306 2.554544 1.218793
C 2.092651 2.572073 -0.309657
C -2.603326 1.763418 0.375705
C -3.732283 0.961894 -0.287616
C 1.071557 -2.083391 -0.702751
C -0.286865 -2.241902 0.016301
C 2.224573 -1.688736 0.247357
C -1.430398 -2.639837 -0.942904
C 3.571842 -1.471376 -0.477361
C -2.815012 -2.725416 -0.249063
C 4.712152 -1.031722 0.469105
C -3.308255 -1.394845 0.300935
C 6.055441 -0.816935 -0.261078
H -0.672234 3.805857 0.424382
H -0.038436 2.419957 2.306170
H 0.325621 1.023499 1.250141
H -1.699009 2.515637 -1.465557
H -0.962450 1.014537 -0.862408
H 2.587438 1.862739 1.730550
H 2.039540 3.567969 1.635591
H 2.298654 1.550619 -0.696172
H 2.888855 3.254912 -0.651729
H -3.028659 2.744009 0.676615
H -2.306115 1.248265 1.308286
H -4.049434 1.414669 -1.241930
H -4.593401 0.853238 0.395632
H 0.972843 -1.314271 -1.497498
H 1.329220 -3.031755 -1.219239
H -0.542873 -1.285369 0.518342
H -0.196271 -2.999233 0.822424
H 1.948594 -0.758149 0.787933
H 2.346757 -2.470955 1.025476
H -1.204336 -3.626544 -1.393968
H -1.492508 -1.911283 -1.772742
H 3.867022 -2.407487 -0.995849
H 3.441852 -0.706192 -1.271966
H -3.566430 -3.087194 -0.977976
H -2.792728 -3.437449 0.594125
H 4.839853 -1.793340 1.265455
H 4.415622 -0.093321 0.983152
H 5.963410 -0.036268 -1.039722
H 6.388557 -1.747354 -0.758519
H 6.852359 -0.504400 0.438616


