%chk=000051397.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051397

0 1
 Cl   8.149000       1.234200     -0.5817000    
 O  -0.5535000      0.1887000      0.4634000    
 O    2.810000      -1.009800      0.3850000    
 O   0.3487000      -1.761500     -0.3801000    
 N   -4.207100      0.4652000      4.8300002E-02
 C   -4.605000     -0.7693000      0.7332000    
 C   -5.145900       1.575800      0.2145000    
 C   -6.077800      -1.180100      0.6417000    
 C   -6.178900       1.581800     -0.9160000    
 C   -6.727300     -0.9291000     -0.7152000    
 C   -7.251400      0.4990000     -0.8446000    
 C   -2.853400      0.8459000      0.4561000    
 C   -1.852400     -0.2293000      6.4599998E-02
 C   0.4670000     -0.6793000      0.1784000    
 C    1.768300     -9.4999999E-02  0.6615000    
 C    4.060000     -0.4853000      0.1601000    
 C    4.426100      0.7016000      0.7804000    
 C    4.938300      -1.148900     -0.6859000    
 C    5.694300       1.234900      0.5501000    
 C    6.206500     -0.6157000     -0.9159000    
 C    6.584500      0.5762000     -0.2980000    
 H   -4.050700      -1.605500      0.2916000    
 H   -4.339900     -0.7326000       1.798400    
 H   -5.622500       1.576100       1.202500    
 H   -4.614600       2.533900      0.1385000    
 H   -6.652300     -0.6764000       1.429300    
 H   -6.139100      -2.253000      0.8656000    
 H   -6.684200       2.556200     -0.9161000    
 H   -5.662300       1.513200      -1.882700    
 H   -7.585500      -1.605900     -0.8123000    
 H   -6.041600      -1.172000      -1.535000    
 H   -7.863900      0.5645000      -1.752500    
 H   -7.926200      0.7170000     -7.1000000E-03
 H   -2.549700       1.774600     -4.5200001E-02
 H   -2.793700       1.052000       1.533200    
 H   -1.867100     -0.3889000      -1.020500    
 H   -2.051300      -1.177700      0.5727000    
 H    1.899900      0.8524000      0.1240000    
 H    1.700800      6.4499997E-02   1.742600    
 H    3.771700       1.229400       1.467100    
 H    4.646700      -2.076900      -1.169300    
 H    5.977700       2.161600       1.042800    
 H    6.889700      -1.139900      -1.579400    


%chk=000051397-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051397

0 1
Cl 8.614774 0.872547 0.464603
O -0.571055 0.284038 -0.020408
O 2.870145 -0.792031 -0.305055
O 0.317566 -1.685140 -0.921132
N -4.306663 0.377872 0.290613
C -4.726197 -0.926805 0.861849
C -5.250413 1.513588 0.460992
C -6.237188 -1.230140 0.758564
C -6.258760 1.622214 -0.709678
C -6.883271 -0.914666 -0.615590
C -7.374051 0.550798 -0.727054
C -2.888204 0.683404 0.563577
C -1.960881 -0.197822 -0.287555
C 0.469942 -0.565211 -0.403563
C 1.782495 0.147304 -0.084863
C 4.177047 -0.317457 -0.099517
C 4.503966 0.995731 0.320815
C 5.200681 -1.266358 -0.345746
C 5.861652 1.355566 0.492420
C 6.550896 -0.907662 -0.174363
C 6.864228 0.403502 0.243444
H -4.177516 -1.726008 0.324426
H -4.425735 -1.006052 1.940248
H -5.794986 1.467759 1.433298
H -4.654376 2.445271 0.485948
H -6.792001 -0.681523 1.545380
H -6.359558 -2.305404 0.995295
H -6.734369 2.624923 -0.677610
H -5.673166 1.567436 -1.647856
H -7.754273 -1.583283 -0.763854
H -6.164612 -1.138621 -1.428582
H -7.962296 0.670680 -1.659058
H -8.076889 0.743425 0.111185
H -2.689725 1.736619 0.296994
H -2.612234 0.554724 1.640918
H -2.179079 -0.076401 -1.362991
H -2.013289 -1.269092 -0.028804
H 1.873361 1.033576 -0.746825
H 1.753447 0.502003 0.964824
H 3.731820 1.744294 0.519499
H 4.919362 -2.272357 -0.669612
H 6.125824 2.366317 0.816224
H 7.345479 -1.634957 -0.363302


