%chk=000052529.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052529

0 1
 Cl  -4.992900       1.224400     -0.2093000    
 O    5.124400      -1.205700      0.2942000    
 O   -4.125700      -3.091200      6.2399998E-02
 N   -4.493300      -1.749000     -2.6400000E-02
 N  -7.2200000E-02   3.842500     -0.1193000    
 C    1.424800      0.6123000      9.6799999E-02
 C   -1.024800      0.5301000      1.2800000E-02
 C   0.1001000       1.264100      2.5800001E-02
 C    1.996700      0.3812000       1.334700    
 C    2.060800      0.2498000      -1.076800    
 C   -2.322600       1.180000     -8.2300000E-02
 C  -0.9529000     -0.9187000      9.3599997E-02
 C    3.904400     -0.6064000      0.2290000    
 C    3.247200     -0.2334000       1.401400    
 C    3.311200     -0.3648000      -1.010100    
 C   -3.453500      0.4605000     -9.6600004E-02
 C   -2.062900      -1.667700      8.2099997E-02
 C   -3.413100      -1.033100     -1.4600000E-02
 C   3.7000000E-03   2.686100     -5.4800000E-02
 C    5.740600      -1.561100     -0.9427000    
 H    1.494900      0.6673000       2.255200    
 H    1.608400      0.4335000      -2.047700    
 H   -2.403800       2.260100     -0.1439000    
 H  -6.8000001E-03  -1.442700      0.1676000    
 H    3.704300     -0.4189000       2.369500    
 H    3.765800     -0.6285000      -1.959000    
 H   -1.946200      -2.743300      0.1459000    
 H    5.151400      -2.307700      -1.485900    
 H    6.702500      -2.025900     -0.7028000    
 H    5.955900     -0.6777000      -1.553400    
 H   -4.991400      -3.533100      4.5899998E-02


%chk=000052529-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000052529

0 1
Cl -5.109828 1.288471 -0.225077
O 5.498810 -0.702177 0.019275
O -4.563911 -3.093232 -0.693469
N -4.746964 -1.661243 -0.532578
N -0.096585 3.653305 1.168434
C 1.472499 0.616092 0.297628
C -1.098311 0.397526 0.199126
C 0.092132 1.130337 0.429809
C 2.510569 1.116620 1.144448
C 1.833811 -0.332534 -0.702051
C -2.384742 1.077050 0.133039
C -1.111422 -1.053424 0.063966
C 4.159287 -0.313179 0.047362
C 3.827631 0.655486 1.032165
C 3.156549 -0.798239 -0.832257
C -3.544811 0.380662 -0.111364
C -2.276866 -1.750239 -0.161533
C -3.561556 -1.068891 -0.290708
C -0.022360 2.505915 0.827303
C 5.908549 -1.691365 -0.985017
H 2.268600 1.866263 1.905728
H 1.083249 -0.667681 -1.424883
H -2.421191 2.163931 0.255277
H -0.176908 -1.602251 0.209656
H 4.619300 1.027413 1.688858
H 3.397495 -1.511119 -1.626092
H -2.282601 -2.841276 -0.224935
H 5.368241 -2.647503 -0.847793
H 6.983522 -1.843367 -0.812724
H 5.744207 -1.310320 -2.010955
H -5.491396 -3.408033 -0.849339


