%chk=000105226.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105226

0 1
 Cl  -1.640800       3.041400      0.5960000    
 O    2.589000      0.2612000      0.3829000    
 O   -2.926300      0.3283000      0.4430000    
 O   0.4813000      -3.225700      0.1909000    
 O    2.420700      -2.198000      0.2336000    
 N    1.167100      -2.177600      0.2480000    
 C    3.227400      0.9603000     -0.6832000    
 C   -3.585300     -0.2382000     -0.6874000    
 C    1.225700      0.2659000      0.3970000    
 C   -1.563200      0.3277000      0.4291000    
 C   0.5009000     -0.9241000      0.3315000    
 C  -0.8935000     -0.8933000      0.3477000    
 C   0.5559000       1.486800      0.4786000    
 C  -0.8385000       1.517600      0.4946000    
 C    4.078600       2.081800     -0.1076000    
 C    4.057100     -1.9600000E-02  -1.498800    
 C   -4.422600      -1.425100     -0.2357000    
 C   -4.433300      0.8303000      -1.360300    
 H    2.491100       1.406400      -1.365900    
 H   -2.862200     -0.5936000      -1.434300    
 H   -1.473800      -1.811100      0.3110000    
 H    1.115800       2.416200      0.5416000    
 H    4.586900       2.641200     -0.8989000    
 H    3.467900       2.780400      0.4729000    
 H    4.834200       1.683100      0.5783000    
 H    4.595900      0.4890000      -2.304200    
 H    3.416300     -0.7867000      -1.946000    
 H    4.783200     -0.5408000     -0.8655000    
 H   -4.947500      -1.884500      -1.078900    
 H   -3.799600      -2.188000      0.2412000    
 H   -5.163700      -1.116500      0.5099000    
 H   -4.964700      0.4301000      -2.229200    
 H   -3.805800       1.665300      -1.690300    
 H   -5.166800       1.245500     -0.6604000    


%chk=000105226-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000105226

0 1
Cl -1.400527 3.258273 -0.657629
O 2.667809 -0.032760 -0.564946
O -2.942187 0.731409 -0.630099
O -0.004636 -3.304947 -0.437183
O 2.164179 -2.613932 -0.457988
N 0.899741 -2.368599 -0.470807
C 3.603297 1.144848 -0.560641
C -3.913274 -0.409999 -0.565127
C 1.299429 0.160270 -0.553060
C -1.579366 0.469896 -0.583280
C 0.421112 -0.970519 -0.522298
C -0.985469 -0.805377 -0.538496
C 0.689594 1.446992 -0.588750
C -0.701544 1.590522 -0.604800
C 3.708353 1.718180 0.861903
C 4.923550 0.572794 -1.082273
C -4.038504 -0.913206 0.882315
C -5.218283 0.165813 -1.120372
H 3.215864 1.902466 -1.272422
H -3.543268 -1.214632 -1.233473
H -1.578093 -1.722024 -0.517748
H 1.299777 2.351453 -0.609531
H 4.406332 2.575037 0.871734
H 2.734487 2.065546 1.247840
H 4.096329 0.946116 1.548617
H 5.691425 1.366412 -1.118675
H 4.795330 0.155853 -2.095027
H 5.277729 -0.235156 -0.419722
H -4.754021 -1.754234 0.927324
H -3.074847 -1.266883 1.287007
H -4.411942 -0.102583 1.532125
H -6.002063 -0.612654 -1.128367
H -5.075515 0.534136 -2.150154
H -5.563397 1.007188 -0.494796


