%chk=000127469.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127469

0 1
 Cl   2.032700       1.875300      -2.134400    
 Cl   1.233300      0.3689000       2.987700    
 Cl  -1.096700       2.312200      -2.494100    
 Cl  -1.895500      0.8058000       2.627800    
 O    2.812000      -2.594600      0.4405000    
 O   -2.690300     -0.4624000      -2.353600    
 N    3.291400     -0.4489000      0.2235000    
 N   -3.414500      0.5230000     -0.5372000    
 N    2.375000      -1.471600      0.1687000    
 N   -2.767300     -0.5434000      -1.123500    
 N   -7.356000      -2.133600      0.2020000    
 N    8.677100      -1.373500     -0.8948000    
 N    9.326400      0.3960000      0.6064000    
 N   -9.530700      -1.107600      0.3599000    
 N    7.703900       1.633200       1.777400    
 N   -9.776000       1.223700      0.1557000    
 N   -9.279700      -3.427800      0.5620000    
 N    10.93750     -0.8399000     -0.5619000    
 C    1.437800       1.149800      0.4042000    
 C   -1.304100       1.531700      8.8600002E-02
 C    2.917300      0.9428000      0.5740000    
 C   -2.780600       1.737300     -8.1200004E-02
 C   0.9337000       1.581900     -0.8206000    
 C   0.5759000      0.9079000       1.471700    
 C  -0.4390000       1.773100     -0.9784000    
 C  -0.7968000       1.099000       1.313800    
 C    4.654000     -0.6773000     -5.4000001E-02
 C   -4.846900      0.4374000     -0.3567000    
 C    6.991500     -0.1364000      0.2796000    
 C    5.633900      9.5600002E-02  0.5609000    
 C   -5.416200     -0.8053000     -0.1635000    
 C   -6.792200     -0.9277000      1.3500000E-02
 C   -7.563100      0.2460000     -1.1800000E-02
 C    5.027900      -1.676800     -0.9455000    
 C   -5.585500       1.594500     -0.3845000    
 C    7.381600      -1.143000     -0.6187000    
 C   -6.962700       1.501500     -0.2099000    
 C    6.380100      -1.901300      -1.220000    
 C    8.020000      0.6003000      0.8601000    
 C   -8.933700      8.3999999E-02  0.1689000    
 C   -8.694500      -2.158000      0.3649000    
 C    9.579000     -0.5916000     -0.2674000    
 H    3.228800       1.169900       1.599700    
 H    3.480200       1.668300     -2.6100000E-02
 H   -2.976600       2.561600     -0.7766000    
 H   -3.221800       2.101600      0.8550000    
 H    5.361300      0.8641000       1.277200    
 H   -4.814600      -1.711000     -0.1266000    
 H   -5.160800       2.577400     -0.5534000    
 H    4.302700      -2.280000      -1.485300    
 H   -7.535800       2.424000     -0.2296000    
 H    6.646500      -2.683500      -1.928500    
 H    7.268200       1.305000       2.634800    
 H    7.189500       2.407300       1.366600    
 H   -9.556400       1.978700     -0.4816000    
 H   -10.76000       1.044500      0.3196000    
 H   -8.691500      -4.249600      0.5740000    
 H   -10.27960      -3.499900      0.6893000    
 H    11.65260     -0.2806000     -0.1178000    
 H    11.17850      -1.573200      -1.214300    


%chk=000127469-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127469

0 1
Cl 2.347592 1.564763 -2.005024
Cl 0.833032 -0.108204 3.079429
Cl -0.720742 2.086635 -2.751647
Cl -2.229476 0.464936 2.350902
O 2.990708 -2.833379 -0.202039
O -3.446605 -1.680205 -1.754884
N 3.485590 -0.650054 0.243761
N -3.584489 0.363601 -0.737447
N 2.545100 -1.707651 0.201996
N -2.822039 -0.627009 -1.409151
N -7.716109 -2.006668 0.365834
N 8.994517 -0.925682 -1.102698
N 9.544119 0.590469 0.752335
N -9.853915 -0.799454 0.509794
N 7.952905 1.467377 2.189530
N -10.046634 1.480624 0.135339
N -9.713808 -3.095752 0.902172
N 11.193184 -0.258545 -0.663673
C 1.444844 0.772079 0.501900
C -1.326846 1.265896 -0.153817
C 2.911651 0.584293 0.846925
C -2.780280 1.585270 -0.454751
C 1.057553 1.260266 -0.771763
C 0.410931 0.536213 1.441496
C -0.293456 1.495002 -1.095861
C -0.939296 0.783217 1.122022
C 4.882681 -0.730776 -0.072342
C -5.000264 0.355825 -0.501738
C 7.201114 -0.044593 0.373035
C 5.817155 -0.005479 0.691250
C -5.679448 -0.832632 -0.186885
C -7.090244 -0.813761 0.045683
C -7.807915 0.437924 -0.050203
C 5.333548 -1.523111 -1.182306
C -5.716006 1.597632 -0.600803
C 7.662540 -0.843752 -0.741231
C -7.093019 1.626150 -0.372816
C 6.689293 -1.571729 -1.498578
C 8.241957 0.671325 1.103358
C -9.241492 0.365084 0.200868
C -9.054415 -1.932526 0.579722
C 9.857620 -0.206369 -0.339269
H 3.027265 0.556874 1.945038
H 3.490808 1.434361 0.448330
H -2.832260 2.278895 -1.312303
H -3.234349 2.073072 0.423769
H 5.462999 0.579912 1.547812
H -5.166037 -1.789645 -0.103485
H -5.192838 2.518797 -0.872558
H 4.610636 -2.080973 -1.778471
H -7.610927 2.589303 -0.456704
H 7.050911 -2.166601 -2.342125
H 8.732382 1.930299 2.653237
H 7.012469 1.582914 2.551660
H -9.688289 2.400456 -0.098690
H -11.040314 1.356052 0.318989
H -9.182126 -3.959968 0.960213
H -10.716611 -3.072137 1.062248
H 11.861619 0.266743 -0.107566
H 11.484724 -0.830801 -1.451322


