%chk=000100670.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100670

0 1
 Cl  -3.773200       2.310600      -3.385500    
 Cl  -5.060300       1.324700       3.370900    
 O  -0.5611000       1.329600      0.5474000    
 O   -1.770400      -2.103800      0.1130000    
 O    1.055000      -2.308000     -0.5172000    
 O    2.615800     -0.4541000       1.033600    
 O    1.689000       2.711200     -0.2844000    
 O   -1.229800      -2.949700      -1.967700    
 O    2.271000      -3.195900       1.234700    
 O    3.792700     -2.6000000E-03 -0.9025000    
 O    2.898900       4.577600      0.3401000    
 N   -2.783100      0.6075000      0.1274000    
 C  -0.9198000     -0.9808000     -0.1138000    
 C   0.4936000      -1.329100      0.3598000    
 C   -1.468300      0.2306000      0.6502000    
 C    1.397400     -9.5700003E-02  0.3876000    
 C   0.7137000       1.054600       1.134300    
 C    1.525400       2.344800       1.073600    
 C   -2.639300       1.388100      -1.100500    
 C   -3.533000       1.363100       1.129700    
 C   -3.945600       1.378200      -1.879200    
 C   -4.129200      0.4142000       2.157800    
 C   -1.829800      -3.013500     -0.9033000    
 C    1.931700      -3.179900      5.9300002E-02
 C    3.742500     -0.3604000      0.2666000    
 C   -2.754700      -4.131200     -0.5270000    
 C    2.435900      -4.142400     -0.9729000    
 C    4.939500     -0.7652000       1.072500    
 C    2.401800       3.858100     -0.5157000    
 C    2.493900       4.119200      -1.988600    
 H  -0.8614000     -0.7550000      -1.185700    
 H   0.4109000      -1.754700       1.370300    
 H   -1.545800     -5.8300000E-02   1.704800    
 H    1.554300      0.1998000     -0.6581000    
 H   0.5783000      0.7969000       2.193100    
 H    2.503400       2.211000       1.549200    
 H   0.9796000       3.143800       1.589900    
 H   -1.870500      0.9710000      -1.760500    
 H   -2.336600       2.422600     -0.8862000    
 H   -4.367700       1.914100      0.6837000    
 H   -2.902100       2.120200       1.615200    
 H   -4.780200       1.828400      -1.338300    
 H   -4.229500      0.3582000      -2.158600    
 H   -3.377200     -0.1532000       2.710400    
 H   -4.815800     -0.2967000       1.686400    
 H   -3.758100      -3.737000     -0.3471000    
 H   -2.805500      -4.851900      -1.348100    
 H   -2.375800      -4.641500      0.3620000    
 H    1.600000      -4.710000      -1.389700    
 H    3.134300      -4.842400     -0.5056000    
 H    2.962900      -3.597500      -1.760100    
 H    5.028600     -0.1222000       1.951700    
 H    5.841500     -0.6485000      0.4649000    
 H    4.851200      -1.813100       1.368700    
 H    3.009600       3.289900      -2.479200    
 H    3.065300       5.035900      -2.160000    
 H    1.491700       4.249700      -2.404400    


%chk=000100670-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100670

0 1
Cl -4.314288 1.576026 -3.524753
Cl -5.763384 0.506539 3.155301
O -0.618040 1.549352 0.588568
O -1.554284 -2.080577 0.309464
O 1.217920 -1.987669 -0.661283
O 2.756589 -0.011569 0.925384
O 1.889061 3.075064 -0.156471
O -2.526201 -2.254632 -1.811101
O 1.781264 -3.521566 1.019353
O 3.835688 0.256330 -1.135477
O 4.110559 3.181875 0.569211
N -2.815892 0.675900 0.238214
C -0.839223 -0.836777 -0.076121
C 0.627734 -1.056880 0.329114
C -1.501909 0.333358 0.699358
C 1.436844 0.248718 0.304111
C 0.724687 1.324328 1.153933
C 1.455593 2.665216 1.202395
C -2.944996 1.294080 -1.106291
C -3.772998 1.131331 1.272638
C -4.088646 0.640666 -1.895432
C -4.582950 -0.067275 1.791868
C -2.371367 -2.699566 -0.654179
C 1.779231 -3.193543 -0.184335
C 3.899709 0.049581 0.094632
C -3.008399 -3.937980 -0.068569
C 2.352391 -3.972455 -1.344796
C 5.148030 -0.116329 0.921772
C 3.267804 3.289492 -0.351045
C 3.553972 3.609219 -1.795867
H -0.922249 -0.689978 -1.167636
H 0.685917 -1.523962 1.331661
H -1.559181 0.042914 1.771299
H 1.575326 0.605541 -0.731957
H 0.627770 0.957420 2.202593
H 2.341787 2.604931 1.857486
H 0.760864 3.443504 1.558448
H -1.999462 1.173312 -1.658719
H -3.118719 2.385461 -1.020702
H -4.459921 1.877902 0.836800
H -3.252446 1.628215 2.114609
H -5.059652 0.720461 -1.382320
H -3.861397 -0.398900 -2.166463
H -3.943274 -0.835359 2.252698
H -5.214644 -0.510001 1.007459
H -3.736133 -3.651808 0.712015
H -3.525906 -4.498510 -0.859919
H -2.245619 -4.572294 0.412802
H 1.569599 -4.163545 -2.098828
H 2.769199 -4.924115 -0.985873
H 3.140815 -3.379535 -1.840381
H 5.433084 0.880245 1.307718
H 5.967972 -0.493631 0.292568
H 4.973944 -0.784957 1.778629
H 3.791958 2.660475 -2.312335
H 4.431097 4.270537 -1.867025
H 2.680372 4.064719 -2.285322


