%chk=000104429.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104429

0 1
 O    4.178900     -0.7720000       1.219900    
 O   -4.933100      -1.359700     -0.9102000    
 O    6.445700       1.845100      -1.347100    
 O   -3.693600       4.254900      0.1505000    
 O    6.431600     -0.3783000     -0.7028000    
 O    5.905100       4.089800      -1.550600    
 O   -1.998100       3.175800      -1.003800    
 O   -5.684600       4.685400       1.256400    
 C  -0.1325000      -4.190100     -2.8899999E-02
 C    1.063700      -3.242500      0.3178000    
 C   -1.401500      -3.442500     -0.2621000    
 C   0.3831000      -5.052000      -1.242700    
 C  -0.3800000      -5.253100       1.098600    
 C    1.407500      -2.308400     -0.6082000    
 C    1.672900      -3.420500       1.519900    
 C   -1.940400      -2.650400      0.7517000    
 C   -2.049400      -3.534600      -1.493900    
 C    2.473100      -1.463000     -0.2994000    
 C    2.738500      -2.575200       1.828900    
 C   -3.126900      -1.950300      0.5337000    
 C   -3.236100      -2.834500      -1.712000    
 C    3.138700      -1.596500      0.9192000    
 C   -3.755300      -2.053900     -0.6945000    
 C    4.024700      0.5796000      0.9609000    
 C    4.861100       1.233600      0.1021000    
 C   -4.985600     -6.1200000E-02 -0.5000000    
 C    4.705100       2.571900     -0.1523000    
 C   -4.019800       2.099200     -0.3308000    
 C   -3.914500      0.7944000     -0.7706000    
 C    3.006800       1.279900       1.581500    
 C   -5.123800       2.551500      0.3450000    
 C   -6.119200      0.4031000      0.1940000    
 C    3.705700       3.318100      0.4405000    
 C   -6.197100       1.729600      0.6268000    
 C    5.986200      0.7502000     -0.6664000    
 C    2.846700       2.654200       1.320300    
 C    5.726300       2.980900      -1.090400    
 C   -3.084800       3.194000     -0.4636000    
 C   -4.925000       3.947800      0.6629000    
 H  -0.3387000      -5.833600      -1.510100    
 H   0.5694000      -4.452100      -2.140900    
 H    1.326200      -5.556100     -0.9951000    
 H   -1.205500      -5.919100      0.8133000    
 H   0.4936000      -5.895100       1.266100    
 H  -0.6693000      -4.803100       2.055500    
 H   0.8970000      -2.192600      -1.557700    
 H    1.407000      -4.155600       2.266200    
 H   -1.454800      -2.563500       1.719900    
 H   -1.674600      -4.135800      -2.314700    
 H    2.773400     -0.7217000      -1.034800    
 H    3.253100      -2.682200       2.780100    
 H   -3.537900      -1.358900       1.346700    
 H   -3.739800      -2.906500      -2.671200    
 H   -3.037500      0.4721000      -1.321300    
 H    2.328400      0.7952000       2.278100    
 H   -6.944400     -0.2747000      0.3979000    
 H    3.584700       4.376000      0.2381000    
 H   -7.068600       2.089400       1.161400    
 H    2.047100       3.203000       1.810700    


%chk=000104429-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000104429

0 1
O 3.862302 -0.547442 0.666613
O -4.954966 -1.350654 -0.220338
O 6.898278 2.618288 0.069940
O -2.843544 4.311771 0.269754
O 6.836633 0.284452 0.381736
O 6.240263 4.858572 -0.205291
O -1.110263 2.740739 0.095485
O -5.002570 5.270683 0.412106
C -0.177756 -4.660229 -0.082275
C 0.942123 -3.601826 0.116443
C -1.514709 -3.872433 -0.120016
C 0.090032 -5.443282 -1.398332
C -0.229805 -5.699011 1.073797
C 1.091731 -2.570124 -0.851092
C 1.804373 -3.582070 1.240277
C -1.889456 -3.108740 1.020549
C -2.353524 -3.816923 -1.259873
C 2.039269 -1.541939 -0.698391
C 2.753782 -2.549835 1.419891
C -3.028361 -2.284289 1.014385
C -3.494227 -2.978758 -1.293197
C 2.847378 -1.525728 0.460596
C -3.800218 -2.202200 -0.164415
C 3.625136 0.809079 0.432597
C 4.750952 1.648786 0.281527
C -4.780512 0.030810 -0.080521
C 4.576371 3.042713 0.101856
C -3.496403 2.055667 0.065734
C -3.505966 0.662715 -0.067788
C 2.333740 1.407996 0.405501
C -4.681951 2.817308 0.172869
C -5.983545 0.786500 0.022207
C 3.312398 3.647336 0.063339
C -5.944053 2.189197 0.147523
C 6.200124 1.334378 0.268552
C 2.184231 2.801296 0.221350
C 5.919021 3.676061 -0.033358
C -2.326920 2.979062 0.131511
C -4.326859 4.246279 0.299388
H -0.701518 -6.193083 -1.582099
H 0.155067 -4.781914 -2.279784
H 1.052320 -5.978092 -1.317385
H -1.049090 -6.415928 0.889693
H 0.714483 -6.270240 1.131907
H -0.411598 -5.232650 2.057716
H 0.444820 -2.556722 -1.735601
H 1.741004 -4.367227 1.999473
H -1.262252 -3.133044 1.918215
H -2.115590 -4.407613 -2.149075
H 2.146952 -0.767326 -1.464048
H 3.416937 -2.528730 2.289493
H -3.304353 -1.699847 1.898190
H -4.127357 -2.914497 -2.183127
H -2.575673 0.097270 -0.158756
H 1.440558 0.791814 0.539167
H -6.933020 0.244309 0.001063
H 3.208533 4.726339 -0.079351
H -6.865044 2.773820 0.227447
H 1.171194 3.214556 0.204723


