%chk=000088323.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088323

0 1
 Cl   7.541100       3.512000     -0.7576000    
 O   -1.920500       1.486800      9.9999997E-05
 O   -6.419800       2.591600      0.7426000    
 N   0.5982000      -2.040600      0.1151000    
 N    3.381300      -1.517300      0.6976000    
 N   -2.955200      -1.219400     -0.7579000    
 N   -5.924100      0.4355000      2.2500001E-02
 N   -5.102700      -1.756500     -0.7377000    
 N   -4.166700       2.063600      0.3788000    
 C    1.226700     -0.7653000     -0.2509000    
 C    1.248900      -2.610300       1.301400    
 C    2.730000     -0.9459000     -0.4876000    
 C    2.752100      -2.792000       1.064100    
 C  -0.8349000      -1.866800      0.3424000    
 C   -1.515000      -1.382000     -0.9348000    
 C    4.814200      -1.692500      0.4688000    
 C   -3.604900     -0.1018000     -0.3508000    
 C    5.496900     -0.3863000      0.1611000    
 C   -4.926300     -0.4566000     -0.3456000    
 C   -3.883100      -2.190300     -0.9805000    
 C   -3.111400       1.187400      1.0700000E-02
 C    5.599400      3.7599999E-02  -1.156400    
 C    6.015400      0.3748000       1.199500    
 C   -5.574800       1.754800      0.4051000    
 C   -7.318500      1.0700000E-02  1.1900000E-02
 C    6.233200       1.247200      -1.441300    
 C    6.649000       1.584300      0.9145000    
 C   -3.786600       3.416800      0.7707000    
 C    6.757900       2.020400     -0.4058000    
 H    1.059700     -6.0999999E-03  0.5253000    
 H   0.8322000     -0.3714000      -1.191400    
 H   0.8155000      -3.592100       1.527200    
 H    1.088500      -1.971900       2.180900    
 H    2.892200      -1.574100      -1.373800    
 H    3.100600      5.9599999E-02 -0.7064000    
 H    3.202100      -3.175900       1.987700    
 H    2.913300      -3.547600      0.2832000    
 H   -1.026000      -1.165800       1.165800    
 H   -1.281000      -2.826200      0.6352000    
 H   -1.377400      -2.109900      -1.744900    
 H   -1.153600     -0.4223000      -1.308000    
 H    5.006300      -2.407600     -0.3434000    
 H    5.283600      -2.127400       1.361600    
 H   -3.625400      -3.186600      -1.313500    
 H    5.209100     -0.5604000      -1.975200    
 H    5.934600      4.5299999E-02   2.231600    
 H   -7.986300      0.8175000      0.3243000    
 H   -7.438500     -0.8328000      0.6986000    
 H   -7.588500     -0.2980000      -1.002800    
 H    6.313800       1.572900      -2.475200    
 H    7.053000       2.176700       1.731600    
 H   -2.707900       3.583300      0.7298000    
 H   -4.141500       3.597700       1.790300    
 H   -4.287000       4.126600      0.1043000    


%chk=000088323-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000088323

0 1
Cl 7.884506 3.665978 0.638870
O -1.891862 1.264339 -0.559360
O -6.184799 2.849368 0.583654
N 0.534173 -1.960473 0.097374
N 3.394061 -1.555196 0.190552
N -3.184604 -1.581040 -0.503816
N -5.932723 0.529559 0.330813
N -5.403858 -1.867100 -0.010082
N -4.061814 2.030235 0.017600
C 1.124868 -0.613517 -0.128970
C 1.388505 -2.755864 1.011928
C 2.537562 -0.746276 -0.713598
C 2.802201 -2.894020 0.420003
C -0.890692 -1.906714 0.478935
C -1.769227 -1.888975 -0.799615
C 4.806052 -1.610377 -0.246550
C -3.715441 -0.304891 -0.250185
C 5.537970 -0.284209 -0.055685
C -5.073695 -0.519495 0.041881
C -4.230246 -2.473108 -0.339889
C -3.108278 1.000336 -0.292228
C 6.543184 0.126820 -0.964328
C 5.255829 0.535107 1.066066
C -5.445048 1.857655 0.327656
C -7.354245 0.271679 0.634238
C 7.266280 1.325266 -0.761015
C 5.962621 1.737450 1.285333
C -3.587037 3.433696 0.018212
C 6.962294 2.111303 0.365884
H 1.182050 -0.040443 0.829432
H 0.479334 -0.037759 -0.814566
H 0.943991 -3.761011 1.135742
H 1.470662 -2.282145 2.022143
H 2.471440 -1.211296 -1.729338
H 2.986449 0.256852 -0.824432
H 3.444095 -3.451711 1.128089
H 2.732450 -3.486122 -0.527720
H -1.130197 -1.007716 1.092800
H -1.143708 -2.797949 1.083492
H -1.720279 -2.868374 -1.304354
H -1.389636 -1.118469 -1.488711
H 4.909204 -1.936493 -1.313162
H 5.307239 -2.387140 0.366595
H -4.110347 -3.545684 -0.473625
H 6.768110 -0.488559 -1.844190
H 4.464179 0.221252 1.754809
H -7.831731 1.240792 0.838436
H -7.438449 -0.389251 1.512866
H -7.840595 -0.220532 -0.224464
H 8.041147 1.641045 -1.465614
H 5.742392 2.369666 2.150656
H -2.514803 3.417317 -0.224982
H -3.754018 3.887909 1.008358
H -4.144317 4.021687 -0.729138


