%chk=000045110.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045110

0 1
 Cl   7.036800      -2.627100     -0.3564000    
 O   -2.498900      -1.838300       1.147000    
 O   -3.906200     -0.8882000      -1.051000    
 O   -1.022200      -2.928400     -0.3057000    
 O   -5.347300      0.2299000      0.4161000    
 N   0.7884000       3.350800      0.3386000    
 C   0.4728000       2.095300       1.072300    
 C  -0.7045000       1.301700      0.4995000    
 C  -0.4161000       4.019400     -0.1673000    
 C    1.736400       1.213500       1.077400    
 C   -1.111000       3.124300      -1.188100    
 C   -1.456400       1.795900     -0.5804000    
 C    2.112500      0.8048000     -0.3393000    
 C    1.545600       4.291600       1.173300    
 C   -1.090800      8.1400000E-02   1.080900    
 C   -2.518000       1.043900      -1.104500    
 C   -2.159000     -0.6543000      0.5650000    
 C   -2.866400     -0.1776000     -0.5334000    
 C    3.349400     -5.6800000E-02 -0.3422000    
 C    4.596400      0.5410000     -0.4472000    
 C    3.220500      -1.434200     -0.2412000    
 C    5.740800     -0.2567000     -0.4512000    
 C    4.364900      -2.231800     -0.2451000    
 C    5.624900      -1.643000     -0.3501000    
 C   -1.837800      -2.952700      0.6064000    
 C   -5.150700     -0.5859000     -0.4747000    
 C   -2.278000      -4.201600       1.311100    
 C   -6.225900      -1.416900      -1.109800    
 H   0.1953000       2.343500       2.106500    
 H  -0.1474000       4.956100     -0.6715000    
 H   -1.099300       4.274200      0.6546000    
 H    2.574700       1.733400       1.556200    
 H    1.580600      0.3192000       1.693900    
 H   -2.021000       3.628200      -1.535100    
 H  -0.4654000       2.960300      -2.059800    
 H    2.297500       1.680700     -0.9737000    
 H    1.307100      0.2484000     -0.8333000    
 H    2.502900       3.871300       1.493900    
 H   0.9841000       4.593400       2.065000    
 H    1.792200       5.195200      0.6037000    
 H  -0.5597000     -0.3031000       1.948500    
 H   -3.081100       1.420500      -1.955500    
 H    4.697100       1.619900     -0.5242000    
 H    2.243500      -1.901900     -0.1570000    
 H    6.716300      0.2159000     -0.5332000    
 H    4.259300      -3.310700     -0.1653000    
 H   -3.352800      -4.342800       1.173500    
 H   -1.754400      -5.062200      0.8853000    
 H   -2.030800      -4.132500       2.373200    
 H   -6.276700      -1.199600      -2.179500    
 H   -7.190300      -1.170600     -0.6566000    
 H   -6.020300      -2.476800     -0.9408000    


%chk=000045110-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000045110

0 1
Cl 6.580452 -3.357666 -0.334181
O -2.453743 -1.831314 0.809443
O -3.949438 -0.695953 -1.275429
O -0.249807 -2.648887 0.662372
O -5.315846 -0.597553 0.634712
N 0.721329 3.560174 0.413293
C 0.461828 2.246159 1.068645
C -0.746894 1.517174 0.458192
C -0.513896 4.288611 0.039160
C 1.731841 1.342161 1.016952
C -1.264546 3.501288 -1.045019
C -1.553566 2.092606 -0.560715
C 2.177612 0.972623 -0.422398
C 1.646176 4.407072 1.193907
C -1.059003 0.218815 0.929228
C -2.637452 1.354478 -1.094223
C -2.111661 -0.518875 0.366292
C -2.912971 0.053986 -0.646628
C 3.266670 -0.089266 -0.423088
C 4.623563 0.244385 -0.662655
C 2.940921 -1.447114 -0.156159
C 5.640127 -0.739422 -0.636972
C 3.940785 -2.444540 -0.127807
C 5.277533 -2.071596 -0.367658
C -1.451955 -2.833290 0.927919
C -5.113649 -1.021986 -0.513791
C -2.093053 -4.112299 1.410536
C -6.002300 -1.922670 -1.338532
H 0.228789 2.408467 2.157563
H -0.220006 5.280663 -0.349447
H -1.187208 4.459878 0.917997
H 2.566499 1.834573 1.550007
H 1.528916 0.413370 1.581231
H -2.206330 4.016630 -1.312884
H -0.632223 3.468472 -1.953618
H 2.513742 1.889579 -0.938570
H 1.294370 0.598706 -0.974126
H 2.627655 3.916829 1.305518
H 1.262797 4.646030 2.218357
H 1.808878 5.358543 0.658010
H -0.466985 -0.235484 1.727355
H -3.275640 1.788478 -1.871215
H 4.894911 1.285056 -0.877612
H 1.898437 -1.736790 0.024448
H 6.684882 -0.475206 -0.825456
H 3.682450 -3.488571 0.072409
H -2.819899 -4.473580 0.662001
H -1.320961 -4.877139 1.574834
H -2.651864 -3.928212 2.343708
H -6.164935 -1.489405 -2.339551
H -6.964002 -2.067240 -0.826059
H -5.509731 -2.900753 -1.481494


