%chk=000087187.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087187

0 1
 Cl -2.4999999E-03   5.943500      1.6000000E-03
 O    4.780300       1.801100      1.5000000E-02
 O   -4.779300       1.800500     -1.5699999E-02
 O    5.570800      -3.469400      0.4071000    
 O   -5.572300      -3.469700     -0.4064000    
 N    2.255700       1.588200      0.6432000    
 N   -2.254800       1.586200     -0.6437000    
 N   3.9999999E-04   1.554700     -1.9999999E-04
 N   -1.154100       3.632200     -0.3298000    
 N    1.153400       3.633200      0.3285000    
 C    3.825900     -0.3180000      0.4794000    
 C   -3.825900     -0.3193000     -0.4794000    
 C    4.042800      -1.693800      0.5808000    
 C   -4.043500      -1.694900     -0.5804000    
 C    6.270000      2.1199999E-02 -0.1478000    
 C   -6.269900      2.1299999E-02  0.1476000    
 C    6.487000      -1.354600     -4.6700001E-02
 C   -6.487500      -1.354400      4.6900000E-02
 C    2.552300      0.2081000      0.7271000    
 C   -2.550600      0.2127000     -0.7269000    
 C    4.931600      0.5898000      0.1116000    
 C   -4.931100      0.5891000     -0.1121000    
 C    5.381100      -2.262400      0.3208000    
 C   -5.382100      -2.262800     -0.3203000    
 C    2.986200      -2.543400      0.9303000    
 C   -2.987300      -2.545200     -0.9296000    
 C    1.502100     -0.6421000       1.074700    
 C   -1.502200     -0.6447000      -1.074600    
 C    7.326400      0.8708000     -0.4976000    
 C   -7.325900      0.8715000      0.4970000    
 C    7.760300      -1.880800     -0.2951000    
 C   -7.761200      -1.879900      0.2953000    
 C    1.718600      -2.014900       1.176100    
 C   -1.719400      -2.017400      -1.175600    
 C    8.593700      0.3422000     -0.7447000    
 C   -8.593500      0.3436000      0.7442000    
 C    8.810300      -1.030600     -0.6435000    
 C   -8.810600      -1.029100      0.6434000    
 C    1.084200       2.289800      0.3089000    
 C   -1.078800       2.291600     -0.3084000    
 C  -6.0000003E-04   4.235700     -8.9999998E-04
 H    3.129800      -3.616800       1.019000    
 H   -3.131500      -3.618600      -1.018000    
 H   0.5146000     -0.2845000       1.344100    
 H  -0.5139000     -0.2883000      -1.343600    
 H    7.186200       1.945000     -0.5836000    
 H   -7.185100       1.945600      0.5828000    
 H    7.955000      -2.947500     -0.2231000    
 H   -7.956300      -2.946500      0.2234000    
 H   0.9032000      -2.673600       1.461300    
 H  -0.9044000      -2.676500      -1.460500    
 H    3.053200       2.202800      0.7666000    
 H   -3.050200       2.203800     -0.7658000    
 H    9.412900       1.001900      -1.016100    
 H   -9.412300       1.003800       1.015500    
 H    9.797800      -1.439500     -0.8363000    
 H   -9.798500      -1.437400      0.8363000    


%chk=000087187-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000087187

0 1
Cl 0.000584 5.664382 -0.001979
O 4.903863 1.893760 -0.144662
O -4.903707 1.894447 0.143841
O 6.340457 -3.401029 0.420717
O -6.340872 -3.400371 -0.419580
N 2.398196 1.288895 0.159994
N -2.398279 1.289508 -0.162821
N -0.000069 1.148705 -0.001585
N -1.208064 3.264854 -0.062573
N 1.208563 3.264533 0.059198
C 4.175344 -0.388789 0.225087
C -4.175503 -0.388204 -0.225876
C 4.570977 -1.756283 0.394580
C -4.571333 -1.755671 -0.395117
C 6.630184 0.231255 -0.160502
C -6.629872 0.231808 0.162725
C 7.020732 -1.130076 -0.011732
C -7.020575 -1.129523 0.014335
C 2.773050 -0.053069 0.328541
C -2.773368 -0.052431 -0.331045
C 5.204984 0.645718 -0.035297
C -5.204832 0.646302 0.035814
C 6.005761 -2.181484 0.281042
C -6.005943 -2.180923 -0.279653
C 3.617188 -2.755563 0.675937
C -3.617898 -2.754863 -0.677975
C 1.831418 -1.079387 0.629462
C -1.832121 -1.078648 -0.633525
C 7.611631 1.217640 -0.430592
C -7.611019 1.218169 0.433992
C 8.384866 -1.490070 -0.135820
C -8.384567 -1.489528 0.139953
C 2.255195 -2.407632 0.803414
C -2.256083 -2.406857 -0.807248
C 8.966866 0.852078 -0.554220
C -8.966106 0.852585 0.559194
C 9.354888 -0.504560 -0.406990
C -9.354284 -0.504047 0.412320
C 1.155238 1.880705 0.076478
C -1.155150 1.881039 -0.079612
C 0.000346 3.853883 -0.001780
H 3.966547 -3.784658 0.799093
H -3.967387 -3.783951 -0.800839
H 0.781289 -0.806940 0.734267
H -0.782101 -0.806262 -0.739566
H 7.286434 2.256700 -0.538060
H -7.285715 2.257235 0.541089
H 8.654925 -2.543730 -0.014502
H -8.654771 -2.543178 0.018868
H 1.513892 -3.176429 1.046091
H -1.515096 -3.175556 -1.051193
H 3.213690 1.941921 0.063146
H -3.213616 1.942567 -0.065173
H 9.722008 1.616829 -0.764111
H -9.721007 1.617315 0.770023
H 10.409080 -0.785159 -0.503010
H -10.408359 -0.784665 0.509539


