%chk=000185337.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185337

0 1
Cl 7.319665 -0.213878 -1.799846
O -4.071330 -1.109168 -0.311446
O 0.204820 2.104809 0.920552
O -1.928802 3.134656 1.005124
O -4.415233 1.802525 0.437613
C 0.740418 -0.820100 0.166804
C 1.961402 -0.231160 0.877193
C 1.323787 -1.507718 1.395545
C -0.580648 -0.159523 0.245602
C 3.288583 -0.251006 0.207551
C -1.767138 -0.857418 -0.042809
C -0.778601 1.176811 0.585304
C -1.941568 -2.294855 -0.433883
C -3.035331 -0.246801 0.012305
C -3.475855 -2.454594 -0.568364
C -2.053916 1.799208 0.639299
C 3.459547 0.420839 -1.014448
C 4.377202 -0.904633 0.805899
C -3.236843 1.110844 0.355545
C -4.102348 -3.393198 0.441875
C -0.495236 3.364000 1.186757
C 4.706888 0.435740 -1.641751
C 5.630409 -0.896193 0.188122
C 5.773241 -0.226112 -1.028403
C -5.616380 1.041758 0.129094
H 0.907184 -1.299399 -0.810698
H 1.813617 0.695007 1.464011
H 1.837999 -2.458238 1.275983
H 0.774613 -1.480271 2.334801
H -1.421783 -2.524256 -1.382314
H -1.510579 -2.973803 0.326123
H -3.796239 -2.669505 -1.607548
H 2.613012 0.935077 -1.471055
H 4.245226 -1.418172 1.757706
H -3.792075 -4.431499 0.280678
H -3.835547 -3.115904 1.471274
H -5.199142 -3.356676 0.385559
H -0.325353 3.627623 2.238808
H -0.171220 4.095079 0.434360
H 4.846853 0.954096 -2.589736
H 6.479753 -1.401190 0.646702
H -5.574831 0.675212 -0.901918
H -6.396730 1.799066 0.262910
H -5.726892 0.211020 0.833723


%chk=000185337-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185337

0 1
Cl 7.605311 0.452599 -1.109594
O -4.163225 -1.196914 -0.395342
O 0.259798 2.108072 0.429090
O -1.881201 3.158697 0.544454
O -4.423506 1.839885 0.139589
C 0.728954 -0.909650 -0.126465
C 1.864302 -0.562566 0.858965
C 1.188658 -1.933766 0.935915
C -0.606449 -0.237192 -0.036603
C 3.272786 -0.357640 0.377361
C -1.828531 -0.938009 -0.206845
C -0.769872 1.144805 0.172138
C -2.043306 -2.406141 -0.547190
C -3.090067 -0.305094 -0.148425
C -3.576653 -2.595959 -0.353213
C -2.027990 1.778624 0.238224
C 3.657124 0.934880 -0.073864
C 4.241296 -1.391577 0.372442
C -3.250292 1.090708 0.087696
C -3.957727 -3.240761 0.984243
C -0.438727 3.414823 0.332753
C 4.969201 1.190416 -0.525377
C 5.561612 -1.156256 -0.080118
C 5.902271 0.133919 -0.523250
C -5.689392 1.148749 0.456375
H 1.065091 -1.142831 -1.146362
H 1.558369 0.148388 1.636540
H 1.731185 -2.813792 0.576245
H 0.526374 -2.119828 1.786794
H -1.742228 -2.613245 -1.592733
H -1.463510 -3.085657 0.102771
H -4.051671 -3.125564 -1.195770
H 2.912661 1.738975 -0.068962
H 3.973959 -2.388615 0.738675
H -3.628615 -4.296269 1.010226
H -3.480700 -2.706078 1.825511
H -5.051429 -3.215296 1.130046
H -0.071704 4.079655 1.127791
H -0.291475 3.826132 -0.686207
H 5.261979 2.185779 -0.872036
H 6.307506 -1.956450 -0.079480
H -5.937967 0.397988 -0.310653
H -6.440182 1.952600 0.478258
H -5.627422 0.657555 1.444991


