%chk=000052839.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052839

0 1
 Cl   5.124500     -0.2548000     -0.3483000    
 O   -1.361500      0.9692000     -0.7016000    
 O   -1.368600      -1.013300      0.6221000    
 N   -4.870200     -0.1054000     -0.2034000    
 C   -3.431100     -0.2448000     -0.3850000    
 C  -0.8209000      0.2970000      0.4408000    
 C   -2.777100       1.122700     -0.5844000    
 C   -2.784400     -0.9572000      0.8038000    
 C   0.6687000      0.1591000      0.2423000    
 C    1.189100     -0.9695000     -0.3941000    
 C    1.531300       1.159500      0.6953000    
 C    2.566000      -1.097500     -0.5767000    
 C    2.908300       1.031700      0.5127000    
 C    3.425700     -9.6799999E-02 -0.1234000    
 H   -3.235500     -0.8467000      -1.281400    
 H   -1.011800      0.8885000       1.346900    
 H   -3.137400       1.596400      -1.504000    
 H   -2.992200       1.806000      0.2468000    
 H   -3.001300     -0.4508000       1.752700    
 H   -3.152100      -1.985700      0.8861000    
 H   -5.266900      0.4124000     -0.9867000    
 H   -5.062100      0.4522000      0.6283000    
 H   0.5413000      -1.757200     -0.7694000    
 H    1.140400       2.044300       1.190600    
 H    2.955000      -1.980900      -1.076700    
 H    3.566100       1.819500      0.8707000    


%chk=000052839-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000052839

0 1
Cl 5.313373 -0.127298 -0.291814
O -1.322375 1.269995 -0.264571
O -1.385258 -1.140537 -0.030321
N -4.950423 0.076394 -0.192930
C -3.512714 0.074150 -0.487284
C -0.785528 0.105343 0.441958
C -2.780573 1.368392 -0.034743
C -2.845057 -1.135878 0.205976
C 0.711406 0.045052 0.221728
C 1.382828 -1.200593 0.243769
C 1.451566 1.236725 0.036514
C 2.785235 -1.261356 0.085757
C 2.854485 1.191526 -0.123011
C 3.497779 -0.060147 -0.091639
H -3.373695 -0.041181 -1.577099
H -1.046304 0.218870 1.526386
H -3.114359 2.248399 -0.607778
H -2.976565 1.540478 1.050357
H -3.045852 -1.101294 1.302291
H -3.225425 -2.083052 -0.202617
H -5.549923 0.543183 -0.874780
H -5.207976 0.268473 0.778416
H 0.802654 -2.119481 0.365020
H 0.924667 2.194237 -0.001412
H 3.309741 -2.220983 0.097333
H 3.431592 2.108482 -0.271505


