%chk=000040200.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040200

0 1
 O    1.530900      0.1212000       2.027400    
 O    2.965400      -2.008600      -1.981100    
 O    2.997900       1.520900     -0.9546000    
 O  -0.9534000      0.6266000       2.251900    
 O   -2.002100      -1.472100      -2.549500    
 O   -3.416600       1.209900       2.632600    
 O    3.168700      -2.777700       2.059000    
 O   -6.472800      8.0600001E-02 -0.8054000    
 O    3.153000       3.810900     -0.6928000    
 C    3.648100     -0.9228000      0.5472000    
 C    2.241900     -0.9360000      3.6499999E-02
 C  -0.1049000     -0.4188000      0.3262000    
 C    4.208200      0.4903000      0.8381000    
 C  -0.3796000     -0.9673000     -0.9283000    
 C    1.209200     -0.4037000      0.8089000    
 C    1.967700      -1.483100      -1.215400    
 C   0.6596000      -1.500300      -1.700200    
 C   -2.573500      0.1252000      0.6292000    
 C   -1.191700      0.1472000       1.151000    
 C   -2.848400     -0.4233000     -0.6252000    
 C   -1.761600     -0.9899000      -1.449600    
 C    4.302100       1.359400     -0.4120000    
 C    3.834400      -1.780200       1.798800    
 C   -3.612700      0.6594000       1.400600    
 C   -4.162400     -0.4379000      -1.108200    
 C   -5.194900      9.5299996E-02 -0.3363000    
 C   -4.920700      0.6426000      0.9155000    
 C    2.543400       2.807900      -1.038600    
 C    1.164800       2.824400      -1.626000    
 H    4.336400      -1.374600     -0.1788000    
 H    3.626300       1.016600       1.600200    
 H    5.220300      0.3954000       1.253700    
 H   0.4569000      -1.929600      -2.678300    
 H    4.795700       2.305300     -0.1643000    
 H    4.918300      0.8635000      -1.170100    
 H    4.693800      -1.515500       2.439300    
 H   -4.389000     -0.8623000      -2.083300    
 H   -5.729000       1.056900       1.513500    
 H   0.7569000      0.5194000       2.451200    
 H    2.587600      -2.339500      -2.813900    
 H   -2.480200       1.178700       2.878800    
 H   -6.481700     -0.3341000      -1.685200    
 H   0.4412000       2.495800     -0.8769000    
 H    1.123900       2.178600      -2.507300    
 H   0.9185000       3.842200      -1.941700    


%chk=000040200-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040200

0 1
O 1.437305 0.145851 2.063283
O 2.994953 -1.918891 -1.961142
O 3.357028 1.602266 -1.315759
O -1.021577 0.601287 2.363000
O -2.104374 -1.475543 -2.650133
O -3.485311 1.085515 2.736984
O 3.033967 -2.650045 2.207896
O -6.652042 -0.018945 -0.666234
O 3.192614 3.637686 -0.181554
C 3.641667 -0.867700 0.591372
C 2.226773 -0.884334 0.050403
C -0.199569 -0.406941 0.339451
C 4.247617 0.553856 0.778405
C -0.462274 -0.955692 -0.954760
C 1.149895 -0.378258 0.827701
C 1.919515 -1.421132 -1.219457
C 0.594714 -1.457249 -1.728915
C -2.649287 0.062472 0.675060
C -1.283393 0.100713 1.161254
C -2.950388 -0.473210 -0.617371
C -1.856199 -1.005190 -1.493343
C 4.585866 1.277592 -0.531526
C 3.759302 -1.683843 1.894495
C -3.724597 0.563957 1.492611
C -4.273543 -0.508706 -1.082982
C -5.318960 -0.007707 -0.256542
C -5.055917 0.525179 1.018920
C 2.737036 2.826316 -1.017546
C 1.474332 2.986369 -1.835244
H 4.281862 -1.412935 -0.136231
H 3.576591 1.178133 1.391989
H 5.198103 0.452543 1.343626
H 0.363910 -1.872748 -2.717131
H 5.121852 2.219745 -0.319604
H 5.173421 0.643774 -1.216529
H 4.616618 -1.370536 2.547234
H -4.465957 -0.926411 -2.078439
H -5.868536 0.904897 1.641466
H 0.538081 0.441825 2.490914
H 2.696925 -2.275260 -2.834093
H -2.467827 1.027629 2.907487
H -6.750574 -0.413580 -1.568646
H 0.702451 2.285804 -1.467739
H 1.663768 2.742407 -2.893537
H 1.100057 4.015938 -1.742493


