%chk=000051339.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051339

0 1
 Cl  -6.462200       3.989000      0.2832000    
 O    1.189400      -2.106700     -0.1686000    
 O    3.977900     -6.8899997E-02  0.7614000    
 O    3.588400      -2.333100      0.9238000    
 O    4.190400       2.869400      2.4499999E-02
 N    6.187200       1.691000      0.2426000    
 C    1.924800     -0.8857000     -0.1130000    
 C    2.184400     -0.3763000      -1.541700    
 C    1.114800      9.0200000E-02  0.7381000    
 C    3.245400      -1.207800      0.5821000    
 C    2.916100      -1.368800      -2.437400    
 C  -0.1746000      -2.002400     -0.1417000    
 C   -2.955800      -1.791100     -8.6300001E-02
 C   -4.442300      -1.678200     -5.7500001E-02
 C  -0.8509000      -2.015600       1.078300    
 C  -0.8889000      -1.883700      -1.333900    
 C   -2.241400      -1.909900       1.105900    
 C   -2.279400      -1.778100      -1.306200    
 C    5.244600     -0.2423000       1.404500    
 C   -4.949300     -0.2525000      2.8200001E-02
 C    5.934300       1.103800       1.530900    
 C   -5.201100      0.4696000      -1.138400    
 C   -5.166000      0.3369000       1.273600    
 C   -5.669300       1.781100      -1.059500    
 C   -5.634100       1.648300       1.352700    
 C   -5.885800       2.370500      0.1861000    
 C    5.289400       2.528400     -0.4051000    
 C    5.813900       3.023000      -1.726500    
 H    2.768300      0.5519000      -1.506300    
 H    1.236500     -0.1191000      -2.027700    
 H    1.671900       1.031000      0.8449000    
 H   0.9652000     -0.2656000       1.763100    
 H   0.1577000      0.3913000      0.2994000    
 H    3.912800      -1.600000      -2.049500    
 H    3.040700     -0.9453000      -3.439300    
 H    2.358100      -2.304500      -2.537800    
 H   -4.872900      -2.163600     -0.9444000    
 H   -4.846400      -2.258100      0.7839000    
 H  -0.3096000      -2.136800       2.012700    
 H  -0.3744000      -1.885800      -2.290500    
 H   -2.755900      -1.928200       2.062900    
 H   -2.823400      -1.689400      -2.242800    
 H    5.089400     -0.6704000       2.401300    
 H    5.859100     -0.9270000      0.8078000    
 H    6.896900      0.9930000       2.039400    
 H    5.309300       1.793000       2.109200    
 H   -5.037200      2.1700000E-02  -2.114900    
 H   -4.974600     -0.2150000       2.190000    
 H    7.070900       1.473300     -0.2092000    
 H   -5.861000       2.331800      -1.976900    
 H   -5.798200       2.094800       2.330000    
 H    6.209600       2.189100      -2.313300    
 H    5.004300       3.494000      -2.290800    
 H    6.606600       3.755700      -1.552900    


%chk=000051339-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000051339

0 1
Cl -8.470729 2.231655 1.169096
O 1.232635 -0.626722 -0.499255
O 3.947308 0.831232 1.418865
O 3.896453 -0.791308 -0.251177
O 8.744202 0.872283 -0.886512
N 6.512389 0.250277 -0.655051
C 1.773727 0.241748 0.588911
C 1.448240 1.740475 0.323318
C 1.259324 -0.207679 1.976295
C 3.298413 0.004920 0.502736
C 1.969264 2.267859 -1.028420
C -0.163861 -0.876623 -0.537395
C -2.924661 -1.532163 -0.790457
C -4.397987 -1.898322 -0.961937
C -0.643139 -2.120782 -0.068138
C -1.057884 0.037299 -1.148532
C -2.012898 -2.440367 -0.197391
C -2.424274 -0.291837 -1.264633
C 5.436682 0.693507 1.570655
C -5.387477 -0.853796 -0.446912
C 6.238281 1.248558 0.382602
C -6.487736 -0.443804 -1.239889
C -5.246825 -0.295835 0.850489
C -7.432045 0.493637 -0.759990
C -6.178160 0.639546 1.350504
C -7.260871 1.019904 0.533123
C 7.769921 0.126313 -1.221638
C 7.905447 -0.967067 -2.277361
H 1.877012 2.331035 1.153358
H 0.348604 1.851107 0.383768
H 1.747550 0.385530 2.766697
H 1.474543 -1.276214 2.150162
H 0.167861 -0.056754 2.041337
H 3.074223 2.302836 -1.049838
H 1.601393 3.292817 -1.213435
H 1.640768 1.621436 -1.860881
H -4.607643 -2.083271 -2.034187
H -4.584851 -2.860827 -0.445281
H 0.065749 -2.829087 0.372372
H -0.678100 0.979042 -1.556269
H -2.374760 -3.410896 0.163884
H -3.112320 0.421212 -1.734228
H 5.625062 1.286081 2.479012
H 5.679869 -0.369374 1.749587
H 7.225292 1.606011 0.733179
H 5.706416 2.132020 -0.027513
H -6.615571 -0.857798 -2.247342
H -4.396065 -0.590475 1.475632
H 5.743233 -0.380459 -0.907092
H -8.277740 0.806261 -1.379431
H -6.065726 1.063535 2.352725
H 6.986259 -1.562720 -2.410107
H 8.173571 -0.504107 -3.243150
H 8.735235 -1.637945 -1.996464


