%chk=000056231.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056231

0 1
 Cl  -2.625800       2.284600      0.8273000    
 O    4.629900      -1.126600      0.5631000    
 O    1.333900       1.460500      -1.027800    
 N  -0.6365000     -0.3983000     -0.6169000    
 N   0.6946000     -0.6402000     -0.3163000    
 N    3.259400      -1.151600      0.3350000    
 C   -1.455900     -0.5573000      0.5844000    
 C   -2.912700     -0.3747000      0.3046000    
 C   -3.523500      0.8764000      0.3910000    
 C   -3.664500      -1.494800     -5.0700001E-02
 C    3.009600      3.3500001E-02 -0.1857000    
 C    1.625200      0.3609000     -0.5579000    
 C   -4.886000       1.007400      0.1219000    
 C   -5.026900      -1.363600     -0.3195000    
 C    4.115600      0.8533000     -0.3239000    
 C    5.128400      7.2300002E-02  0.1667000    
 C   -5.637700     -0.1126000     -0.2332000    
 C    6.572900      0.2711000      0.3377000    
 H   -1.118500      0.1226000       1.376000    
 H   -1.303200      -1.562800       1.002800    
 H  -0.9082000      -1.095900      -1.309500    
 H   -3.203400      -2.476200     -0.1249000    
 H   0.9510000      -1.546200      6.4400002E-02
 H   -5.377000       1.975200      0.1846000    
 H   -5.612200      -2.235500     -0.5967000    
 H    4.192100       1.856900     -0.7150000    
 H   -6.698500     -1.0800000E-02 -0.4428000    
 H    6.851800      0.1797000       1.392000    
 H    7.134300     -0.4754000     -0.2327000    
 H    6.879100       1.263000     -8.9999996E-03


%chk=000056231-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056231

0 1
Cl -2.633709 2.341280 0.720234
O 4.755388 -1.229692 0.427823
O 1.355136 1.640287 -0.858455
N -0.679931 -0.394368 -0.527079
N 0.701134 -0.577547 -0.342898
N 3.306846 -1.229301 0.220320
C -1.498530 -0.618475 0.694929
C -2.966901 -0.428467 0.364193
C -3.589388 0.842989 0.317516
C -3.774433 -1.556146 0.060368
C 3.024408 0.036271 -0.174992
C 1.612850 0.463676 -0.492429
C -4.947332 1.004837 -0.021390
C -5.137003 -1.421226 -0.285199
C 4.191659 0.869553 -0.241233
C 5.248028 0.059537 0.137633
C -5.723270 -0.136221 -0.327360
C 6.720316 0.254331 0.294415
H -1.168925 0.114753 1.450862
H -1.351577 -1.640410 1.120394
H -1.033698 -0.876230 -1.364042
H -3.318834 -2.553166 0.104618
H 1.074879 -1.482755 -0.014332
H -5.389011 2.005246 -0.043249
H -5.735814 -2.308629 -0.514746
H 4.206557 1.915719 -0.531694
H -6.779046 -0.015411 -0.592026
H 7.040278 0.048334 1.331530
H 7.283962 -0.425473 -0.369345
H 6.993262 1.291606 0.044634


