%chk=000012917.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012917

0 1
 Cl   2.516600      -2.709100     -0.1491000    
 O   -5.238500       1.165300      0.2847000    
 O    3.710000       3.448800      5.8200002E-02
 N    4.204700       2.148000     -1.9700000E-02
 N   7.6399997E-02  -3.769200     -7.3100001E-02
 C   0.9487000     -0.4335000      1.8200001E-02
 C    3.395700     -0.1682000     -8.3400004E-02
 C  -0.1612000      -1.196500      4.1200001E-02
 C    2.312200     -0.9788000     -6.7599997E-02
 C   -1.498100     -0.5739000      0.1055000    
 C   0.7640000       1.007200      8.5199997E-02
 C    3.195700       1.332300     -1.0700000E-02
 C    1.803100       1.844800      7.2400004E-02
 C   -2.075900     -0.3397000       1.341300    
 C   -2.144500     -0.2388000      -1.071700    
 C    4.835000     -0.6055000     -0.1689000    
 C   -4.005600      0.5922000      0.2254000    
 C   -3.339600      0.2480000       1.401700    
 C   -3.408100      0.3489000      -1.011200    
 C  -2.7300000E-02  -2.614400     -2.2399999E-02
 C   -5.863200       1.492100     -0.9559000    
 H  -0.2120000       1.473500      0.1505000    
 H    1.588600       2.905800      0.1261000    
 H   -1.567600     -0.6036000       2.264900    
 H   -1.689300     -0.4243000      -2.041000    
 H    5.306100     -0.1819000      -1.062600    
 H    4.967200      -1.688400     -0.2232000    
 H    5.387600     -0.2605000      0.7117000    
 H   -3.800000      0.4351000       2.367900    
 H   -3.869000      0.5909000      -1.962700    
 H   -5.290800       2.245000      -1.508500    
 H   -6.834900       1.938600     -0.7207000    
 H   -6.059400      0.5970000      -1.555800    
 H    4.529500       3.971500      4.4900000E-02


%chk=000012917-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000012917

0 1
Cl 2.577367 -2.670585 -0.143236
O -5.543451 0.697089 -0.054775
O 4.092744 3.549977 -0.359942
N 4.408182 2.129205 -0.391193
N -0.216993 -3.551008 1.535241
C 1.012953 -0.348639 0.249702
C 3.474110 -0.060507 -0.222623
C -0.142247 -1.125986 0.526538
C 2.360512 -0.858809 -0.000214
C -1.525914 -0.609057 0.372237
C 0.896487 1.108020 0.259256
C 3.289966 1.399907 -0.189846
C 1.968518 1.944371 0.066291
C -2.572855 -1.031291 1.249297
C -1.873840 0.257998 -0.704061
C 4.859436 -0.587721 -0.519769
C -4.205280 0.308714 0.019994
C -3.886129 -0.573653 1.086595
C -3.192021 0.717586 -0.885825
C -0.089550 -2.468233 1.033908
C -5.939282 1.597220 -1.144924
H -0.079108 1.531486 0.512007
H 1.860708 3.028978 0.137601
H -2.343001 -1.718464 2.070331
H -1.108545 0.539961 -1.434637
H 5.192949 -0.250813 -1.517948
H 4.896839 -1.685094 -0.481924
H 5.585394 -0.175267 0.202902
H -4.685139 -0.885648 1.765291
H -3.420775 1.366094 -1.736338
H -5.398368 2.560839 -1.083795
H -7.015874 1.764567 -0.998884
H -5.763702 1.129500 -2.132399
H 4.982010 3.967964 -0.493259


