%chk=000105574.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105574

0 1
 O    1.575200      0.4195000     -0.1329000    
 O   -1.880700      0.8198000     -8.6800002E-02
 O    1.983600       3.852700      0.1091000    
 O   -1.445600       4.266600     -0.4449000    
 O    5.005400      1.4000000E-02  0.2847000    
 O    1.146900      -3.017700     -1.7200001E-02
 O    4.616800      -3.423000     -0.1995000    
 O   -3.026900      0.1026000       1.782800    
 C   3.6699999E-02   2.339600     -0.1282000    
 C    3.106100      -1.502000     -3.3000000E-03
 C   0.8670000       1.331000     -0.9622000    
 C    2.371500     -0.4732000     -0.8999000    
 C   -1.013500       1.594100      0.7330000    
 C   0.9540000       3.167000      0.8097000    
 C  -0.6576000       3.299200      -1.127000    
 C    4.054000     -0.7782000      0.9856000    
 C    2.092000      -2.349900      0.8084000    
 C    3.907400      -2.439000     -0.9415000    
 C   -2.853500      0.1148000      0.5719000    
 C   -3.683700     -0.6469000     -0.4359000    
 C   -4.777800      -1.476800      0.2338000    
 C   -5.631900      -2.208900     -0.8002000    
 C   -6.745600      -3.005200     -0.1393000    
 H   0.2085000      0.7649000      -1.633100    
 H    1.585700       1.872200      -1.590900    
 H    3.098900      0.1073000      -1.481400    
 H    1.726900     -0.9988000      -1.616300    
 H   -1.610100       2.313000       1.308400    
 H  -0.5086000      0.9288000       1.445000    
 H   0.3738000       3.908800       1.369900    
 H    1.435900       2.509900       1.542900    
 H   -1.315800       2.747100      -1.807300    
 H   7.9000004E-02   3.833100      -1.737900    
 H    3.489500     -0.1181000       1.653500    
 H    4.599300      -1.497200       1.606600    
 H    1.531500      -1.709100       1.498900    
 H    2.608000      -3.105000       1.411900    
 H    3.243100      -2.957700      -1.641800    
 H    4.635600      -1.872300      -1.532500    
 H    2.508200       4.334400      0.7711000    
 H   -1.852700       4.832700      -1.122700    
 H    5.566300      0.4437000      0.9527000    
 H   0.5518000      -3.512400      0.5715000    
 H    5.096000      -3.974300     -0.8413000    
 H   -3.015600      -1.305300      -1.002500    
 H   -4.135500      7.9400003E-02  -1.120800    
 H   -4.324200      -2.201500      0.9215000    
 H   -5.415700     -0.8229000      0.8416000    
 H   -6.073100      -1.487500      -1.497600    
 H   -5.003400      -2.887000      -1.389100    
 H   -7.412400      -2.349600      0.4298000    
 H   -7.343000      -3.522000     -0.8970000    
 H   -6.337900      -3.757600      0.5434000    


%chk=000105574-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000105574

0 1
O 1.399901 0.625156 -0.091178
O -2.274119 1.511846 0.416120
O 2.327663 3.349173 -0.274991
O -1.355545 4.621087 -0.308333
O 4.944419 -1.011006 -0.510417
O 0.604719 -2.261688 1.597115
O 4.042390 -3.545553 0.317421
O -1.584898 -0.620892 1.053858
C -0.065570 2.577297 -0.132334
C 2.623037 -1.454797 0.356182
C 0.455441 1.367467 -0.936910
C 1.778279 -0.677283 -0.670838
C -1.033284 2.133607 0.984282
C 1.132084 3.308062 0.568102
C -0.752431 3.549917 -1.116094
C 3.995879 -0.751898 0.576333
C 1.875132 -1.557361 1.717473
C 2.841943 -2.877258 -0.233987
C -2.444034 0.140264 0.545698
C -3.799709 -0.297257 0.021786
C -3.803194 -1.740785 -0.528446
C -5.220851 -2.207439 -0.927585
C -5.231678 -3.641086 -1.499731
H -0.381848 0.705276 -1.239525
H 0.972174 1.716426 -1.855720
H 2.370698 -0.514429 -1.596305
H 0.855888 -1.244928 -0.920786
H -1.399774 3.009154 1.540860
H -0.543651 1.400548 1.647531
H 0.856583 4.358401 0.751637
H 1.357055 2.815001 1.535427
H -1.531278 3.017900 -1.701869
H 0.018730 3.956953 -1.803132
H 3.862097 0.342403 0.601137
H 4.424179 -1.070804 1.550434
H 1.746654 -0.543701 2.146308
H 2.488735 -2.152343 2.423392
H 1.936006 -3.487773 -0.060598
H 3.047946 -2.819068 -1.315453
H 2.688834 2.422618 -0.299990
H -1.741318 5.309379 -0.902815
H 5.187681 -1.974194 -0.432121
H -0.142888 -1.628043 1.417587
H 3.859016 -3.842953 1.242644
H -4.143509 0.431739 -0.733040
H -4.513074 -0.224298 0.869283
H -3.132697 -1.804127 -1.408921
H -3.381747 -2.421946 0.234404
H -5.884894 -2.158024 -0.040339
H -5.645940 -1.506677 -1.674986
H -4.836775 -4.364933 -0.762675
H -6.254785 -3.958674 -1.771308
H -4.603873 -3.711355 -2.407886


