%chk=000183596.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183596

0 1
Cl -4.621097 1.748873 -0.578552
F -0.122908 3.282021 1.032510
O 0.956633 -1.634532 1.272573
O -3.355865 -0.768663 -0.700694
N 2.068991 1.619473 0.472818
N 1.065898 0.668608 0.875717
C 3.330145 0.816673 0.197007
C 3.139111 -0.500581 1.000968
C 3.417415 0.635056 -1.328116
C 3.839941 -1.740848 0.445742
C 4.313768 -0.540672 -1.719196
C 3.798273 -1.835218 -1.081834
C 1.616835 -0.649379 1.052658
C -0.283474 0.956211 0.480370
C -1.115038 -0.090848 0.041391
C -0.843197 2.249303 0.588667
C -2.456523 0.156193 -0.269624
C -2.176264 2.514602 0.254728
C -2.983880 1.467771 -0.172399
C -2.978080 -2.200529 -0.737987
C -2.948904 -2.738532 0.681077
C -4.099554 -2.772731 -1.590871
H 4.224256 1.371326 0.561670
H 3.495428 -0.346498 2.052344
H 3.781174 1.574914 -1.786632
H 2.399591 0.486508 -1.748915
H 3.375837 -2.648036 0.890322
H 4.894901 -1.736788 0.787032
H 5.359161 -0.350763 -1.409683
H 4.337773 -0.641722 -2.821385
H 2.763360 -2.039475 -1.421124
H 4.403290 -2.697661 -1.420306
H 2.226973 2.263055 1.272645
H -0.714057 -1.104994 -0.037026
H -2.580607 3.527092 0.336856
H -1.990254 -2.278586 -1.240994
H -2.895454 -3.832863 0.698119
H -2.086980 -2.361072 1.250423
H -3.848738 -2.442468 1.238013
H -3.988851 -3.853373 -1.726721
H -4.124807 -2.299968 -2.582145
H -5.082420 -2.586679 -1.134346


%chk=000183596-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183596

0 1
Cl -4.816181 1.933094 -0.153505
F 0.013628 3.235132 1.216251
O 1.002041 -1.655196 1.140752
O -3.541386 -0.706102 -0.612885
N 2.070997 1.675513 0.249657
N 1.063445 0.656977 0.583430
C 3.330566 0.862063 0.036835
C 3.158332 -0.364220 0.977111
C 3.440681 0.469742 -1.453361
C 3.981470 -1.624231 0.638124
C 4.448652 -0.679028 -1.681598
C 4.025107 -1.928925 -0.876900
C 1.631530 -0.581214 0.927056
C -0.312412 0.951132 0.403120
C -1.215763 -0.049498 -0.033877
C -0.832563 2.234610 0.683789
C -2.596242 0.221600 -0.191498
C -2.186246 2.547858 0.501483
C -3.062431 1.541053 0.065847
C -3.137567 -2.134552 -0.822806
C -2.927788 -2.839638 0.528006
C -4.282327 -2.732825 -1.644997
H 4.192552 1.486251 0.334533
H 3.390109 -0.056451 2.020376
H 3.708638 1.368458 -2.037701
H 2.441157 0.149552 -1.809113
H 3.549211 -2.479629 1.190958
H 5.015988 -1.481700 1.008662
H 5.465812 -0.361989 -1.369460
H 4.505984 -0.914257 -2.761104
H 3.024941 -2.263076 -1.218826
H 4.722935 -2.767430 -1.061799
H 2.158710 2.306311 1.068804
H -0.817696 -1.046877 -0.219312
H -2.547361 3.555100 0.722552
H -2.203007 -2.143540 -1.421477
H -2.675911 -3.902200 0.357099
H -2.109225 -2.390965 1.115259
H -3.856621 -2.793472 1.123295
H -4.064096 -3.788807 -1.885451
H -4.419168 -2.175622 -2.587054
H -5.226695 -2.688802 -1.075174


