%chk=000128291.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128291

0 1
 O  -5.5700000E-02  -1.790600       1.482500    
 O   -1.789400      0.7860000       2.168500    
 O    6.346700     -0.9860000     -0.6778000    
 O   -5.133800      0.2992000      0.4903000    
 O   -6.086600      -2.014000     -0.4897000    
 C  -0.9960000       1.134900     -0.5294000    
 C   0.3627000       1.071800      0.1807000    
 C   -1.943000      4.0000002E-03 -0.1179000    
 C    1.055900     -0.2951000     -0.1379000    
 C    2.484500     -0.3712000      0.5450000    
 C   0.1045000      -1.510800      9.7700000E-02
 C   -1.304900      -1.332100     -0.5127000    
 C   -3.206800      0.3932000     -0.9070000    
 C   -1.849800       2.391000     -0.3829000    
 C   -3.252200       1.934200     -0.8191000    
 C    1.235200       2.267700     -0.2457000    
 C    3.287600      0.8737000      0.1440000    
 C    3.268300      -1.644200      9.0700001E-02
 C    2.710300       2.041000     -0.1810000    
 C   -2.262000     -1.2500000E-02   1.366400    
 C    2.428400     -0.3869000       2.091600    
 C    4.778500      0.6921000      3.7700001E-02
 C    4.044900      -1.427900      -1.210900    
 C   -4.471400     -0.2312000     -0.4003000    
 C    5.121800     -0.3468000      -1.038600    
 C   -4.877900      -1.539600      -1.044300    
 H  -0.7917000       1.031300      -1.608800    
 H   0.2355000       1.156100       1.260800    
 H    1.231500     -0.2922000      -1.226100    
 H   0.5310000      -2.405900     -0.3685000    
 H   -1.223800      -1.395800      -1.605200    
 H   -1.938700      -2.163900     -0.1836000    
 H   -3.094600      0.1257000      -1.966500    
 H   -1.487600       3.208300      -1.015100    
 H   -1.868400       2.761900      0.6469000    
 H   -4.001100       2.325400     -0.1230000    
 H   -3.494400       2.350200      -1.804500    
 H   0.9795000       3.138200      0.3707000    
 H    1.006600       2.545800      -1.282700    
 H    2.604400      -2.505400     -2.0300001E-02
 H    3.989700      -1.939900      0.8658000    
 H    3.333000       2.880700     -0.4804000    
 H   -2.934400     -0.8162000       1.713600    
 H    1.794200      0.4038000       2.501500    
 H    2.075800      -1.344900       2.481500    
 H    3.425300     -0.2405000       2.526600    
 H    5.291900       1.632400     -0.1997000    
 H    5.181500      0.3882000       1.012200    
 H    4.492500      -2.377000      -1.528300    
 H    3.344300      -1.124800      -1.998200    
 H    5.289700      0.1526000      -2.000200    
 H   0.4848000      -2.572500       1.687400    
 H   -4.107000      -2.291400     -0.8688000    
 H   -5.013800      -1.396200      -2.119900    
 H    6.595200      -1.578800      -1.407400    
 H   -6.785500      -1.380300     -0.7256000    


%chk=000128291-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128291

0 1
O -0.311551 -1.553440 1.683744
O -2.094705 0.926156 2.228211
O 6.354243 -1.154176 -0.543628
O -5.218551 -0.108640 0.476020
O -6.082796 -2.212614 -0.949812
C -1.000327 1.159098 -0.493102
C 0.382301 1.108146 0.196459
C -1.940392 -0.005943 -0.078443
C 1.041138 -0.284710 -0.082662
C 2.494976 -0.408998 0.523170
C 0.073586 -1.460601 0.253170
C -1.291813 -1.350931 -0.467046
C -3.241475 0.402326 -0.889123
C -1.874070 2.436172 -0.365301
C -3.337842 1.944667 -0.641873
C 1.266508 2.270574 -0.324386
C 3.317946 0.827592 0.103984
C 3.238349 -1.680295 -0.036805
C 2.752707 2.013042 -0.241965
C -2.292569 -0.023486 1.430359
C 2.514798 -0.483971 2.083758
C 4.818889 0.606239 0.044369
C 3.989262 -1.368578 -1.346982
C -4.498006 -0.369500 -0.530611
C 5.180386 -0.417960 -1.066103
C -4.916649 -1.522192 -1.446416
H -0.804522 1.005973 -1.581318
H 0.235685 1.239170 1.285970
H 1.177677 -0.349516 -1.186995
H 0.549813 -2.421971 -0.023441
H -1.155182 -1.411330 -1.565066
H -1.907780 -2.215664 -0.152520
H -3.006148 0.198617 -1.954946
H -1.561811 3.215908 -1.082134
H -1.798778 2.850653 0.653005
H -3.985699 2.127081 0.232335
H -3.796726 2.449526 -1.510275
H 1.008935 3.200588 0.220842
H 1.012276 2.478502 -1.388533
H 2.528006 -2.515541 -0.175224
H 3.981417 -2.027218 0.707739
H 3.409786 2.847667 -0.529347
H -2.827475 -0.945257 1.758579
H 1.880924 0.295840 2.547331
H 2.218689 -1.485552 2.452909
H 3.541338 -0.311076 2.454293
H 5.358717 1.555562 -0.111957
H 5.194896 0.171857 0.991789
H 4.357951 -2.297597 -1.825078
H 3.304042 -0.885361 -2.072194
H 5.459512 0.107495 -2.003901
H 0.327992 -1.062094 2.254201
H -4.068467 -2.232602 -1.546899
H -5.115601 -1.103815 -2.458177
H 6.681876 -1.775095 -1.243166
H -6.380493 -1.717928 -0.132710


