%chk=000085680.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085680

0 1
 Cl  -3.048900       2.278800      0.3673000    
 O    1.564800       1.439200      -1.233300    
 O    3.165000       1.435800      0.3825000    
 N    3.289400      -1.318000      9.8499998E-02
 C   0.9971000     -0.9468000      0.8812000    
 C    2.028100     -0.6431000     -0.2144000    
 C  -0.4253000     -0.7204000      0.4210000    
 C   -1.001700      0.5273000      0.5902000    
 C   -1.122700      -1.765700     -0.1610000    
 C    2.332700      0.8400000     -0.2869000    
 C   -2.313600      0.7361000      0.1647000    
 C   -2.434700      -1.557000     -0.5863000    
 C   -3.030100     -0.3061000     -0.4235000    
 H    1.190900     -0.3477000       1.781600    
 H    1.083900      -1.994000       1.204100    
 H    1.697400     -0.9999000      -1.196400    
 H  -0.4414000       1.336200       1.052200    
 H  -0.6668000      -2.742300     -0.2947000    
 H    3.646600     -0.9957000      0.9971000    
 H    3.993600      -1.081100     -0.5992000    
 H   -2.992300      -2.368400      -1.045000    
 H   -4.053200     -0.1582000     -0.7597000    
 H    1.753200       2.399400      -1.303000    


%chk=000085680-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085680

0 1
Cl -3.128033 2.327517 0.754719
O 2.279095 1.168235 -1.759406
O 2.041826 1.732959 0.483697
N 3.396479 -1.143042 0.214887
C 1.013169 -1.045640 0.900335
C 2.055409 -0.669688 -0.185042
C -0.421942 -0.763958 0.479339
C -1.032236 0.482151 0.780021
C -1.164494 -1.736229 -0.240056
C 2.085805 0.853067 -0.407457
C -2.352537 0.720042 0.356770
C -2.488796 -1.473248 -0.654060
C -3.101750 -0.233410 -0.357988
H 1.260048 -0.489332 1.824470
H 1.156362 -2.121803 1.102419
H 1.790514 -1.152693 -1.140201
H -0.477816 1.247474 1.332363
H -0.705050 -2.705572 -0.467323
H 3.738211 -0.732020 1.090421
H 4.097000 -1.121681 -0.532394
H -3.054902 -2.232467 -1.204428
H -4.127807 -0.018783 -0.669780
H 2.353444 2.156523 -1.864306


