%chk=000229717.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229717

0 1
Cl 5.255302 -2.011571 -1.096273
O 0.533092 2.576068 -0.503696
O 0.190428 1.621773 1.519726
C -3.847357 -0.689540 1.002339
C -4.615171 0.579989 0.607812
C -3.885199 -1.762596 -0.093972
C -3.866964 1.444611 -0.417504
C -3.012720 -2.979358 0.244997
C -2.663503 2.163350 0.204514
C -1.515875 -2.691311 0.066936
C -1.851532 2.925670 -0.849065
C -0.658859 -3.915164 0.418766
C -0.567922 3.517267 -0.277848
C 0.827843 -3.646565 0.195026
C 0.801818 1.647443 0.474288
C 1.911909 0.757330 0.054504
C 2.381985 -0.190674 0.979564
C 2.479802 0.846678 -1.225930
C 3.422064 -1.052096 0.626981
C 3.519846 -0.012022 -1.588054
C 3.972648 -0.947503 -0.653695
H -2.794796 -0.430937 1.239757
H -4.270317 -1.099864 1.939175
H -5.607489 0.306076 0.200133
H -4.822710 1.177094 1.517392
H -4.929678 -2.093613 -0.252369
H -3.561556 -1.324373 -1.058497
H -4.564068 2.186090 -0.852075
H -3.533494 0.810319 -1.262652
H -3.212682 -3.309960 1.282342
H -3.306510 -3.829249 -0.401299
H -2.009643 1.427263 0.722423
H -3.004251 2.856089 0.997469
H -1.221002 -1.830556 0.698814
H -1.314637 -2.377767 -0.975126
H -1.593471 2.250224 -1.692020
H -2.468303 3.732115 -1.292084
H -0.975976 -4.785043 -0.188948
H -0.832363 -4.204371 1.473636
H -0.209440 4.395730 -0.843863
H -0.631191 3.749649 0.800222
H 1.433303 -4.518308 0.465925
H 1.179627 -2.799727 0.795374
H 1.041462 -3.412203 -0.854205
H 1.926301 -0.246727 1.973833
H 2.103016 1.591090 -1.934317
H 3.797578 -1.790825 1.335655
H 3.969555 0.046407 -2.579409


%chk=000229717-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229717

0 1
Cl 4.648026 -2.608139 -1.091366
O 0.330389 2.612585 -0.638080
O 0.826668 2.421216 1.641813
C -3.723382 -0.768164 0.827414
C -4.578402 0.517468 0.684293
C -3.461846 -1.503150 -0.508707
C -3.984274 1.603846 -0.248646
C -2.753187 -2.870922 -0.346300
C -2.581276 2.095690 0.172429
C -1.323779 -2.783143 0.238626
C -2.059388 3.236261 -0.728247
C -0.601995 -4.150251 0.276142
C -0.646964 3.711441 -0.365094
C 0.814614 -4.069841 0.884819
C 0.981750 2.036439 0.455936
C 1.875638 0.916363 0.036431
C 2.612154 0.238913 1.042299
C 1.997969 0.513851 -1.318586
C 3.462303 -0.833286 0.705942
C 2.845867 -0.557466 -1.668462
C 3.563081 -1.214322 -0.647846
H -2.760316 -0.518632 1.313454
H -4.244263 -1.463163 1.518557
H -5.584433 0.238623 0.307844
H -4.731731 0.957647 1.691413
H -4.432536 -1.655563 -1.025878
H -2.850366 -0.861432 -1.176378
H -4.679337 2.469064 -0.272182
H -3.937655 1.220682 -1.288413
H -3.371370 -3.528532 0.300914
H -2.700701 -3.370216 -1.336413
H -1.866448 1.251236 0.133060
H -2.605406 2.437578 1.227457
H -1.359820 -2.369098 1.266202
H -0.722734 -2.069105 -0.364416
H -2.072913 2.913993 -1.788430
H -2.735355 4.113656 -0.655023
H -0.541721 -4.557929 -0.753922
H -1.216032 -4.868309 0.858090
H -0.318689 4.547585 -1.005792
H -0.565723 3.992557 0.700047
H 1.307744 -5.059351 0.898818
H 0.775540 -3.695172 1.925586
H 1.457045 -3.380354 0.305617
H 2.504557 0.562816 2.082296
H 1.430043 1.042812 -2.088142
H 4.030562 -1.363610 1.474969
H 2.946991 -0.876769 -2.709444


