%chk=000188715.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188715

0 1
Cl -7.929763 2.633215 -1.665095
S 1.434712 -3.246576 0.844798
F 7.148404 -1.862648 -1.224729
O -1.073354 0.415290 1.052497
O -3.895941 -1.192072 0.145414
O 2.854911 1.360849 1.818319
N -0.939055 -1.865203 1.176049
N 1.482809 0.767724 0.105530
N -1.127193 -4.108777 1.443306
N -2.357523 -3.566406 1.633486
C 1.157708 -0.520748 0.731562
C 1.660963 -1.698800 -0.117983
C -0.367403 -0.555323 0.974968
C 3.134485 -1.710558 -0.393759
C -0.257401 -3.122575 1.161038
C -2.304793 -2.228844 1.467081
C 4.065879 -1.223860 0.539482
C 3.584050 -2.251216 -1.613328
C 2.324279 1.683470 0.770489
C -3.438423 -1.267754 1.531875
C 5.434108 -1.270355 0.266374
C 4.946640 -2.308578 -1.906373
C 2.494360 2.986082 0.064613
C 5.844123 -1.814596 -0.953797
C 1.382772 3.787552 -0.229955
C 3.788796 3.412888 -0.262066
C -4.854255 -0.249199 -0.159137
C 1.570690 5.017684 -0.865227
C 3.967254 4.642323 -0.902300
C 2.860322 5.442778 -1.203960
C -5.434129 0.649856 0.743293
C -5.212423 -0.279859 -1.525849
C -6.395720 1.548379 0.265646
C -6.168507 0.616226 -1.985845
C -6.747013 1.521891 -1.083160
H 1.650544 -0.549537 1.763950
H 1.079198 -1.757164 -1.072098
H 1.049941 0.982620 -0.787793
H 3.729561 -0.786198 1.487661
H 2.867416 -2.636478 -2.340935
H -3.118252 -0.259622 1.872051
H -4.270979 -1.663799 2.150799
H 6.156463 -0.892284 0.990804
H 5.297339 -2.729180 -2.848653
H 0.378501 3.461963 0.046308
H 4.649625 2.790893 -0.010404
H 0.711218 5.647715 -1.093495
H 4.971040 4.978809 -1.160885
H 3.002911 6.402945 -1.700709
H -5.159564 0.668492 1.792994
H -4.740126 -1.004410 -2.187239
H -6.864214 2.260928 0.946348
H -6.469193 0.617542 -3.034860


%chk=000188715-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188715

0 1
Cl -7.927057 2.733570 -1.806133
S 1.520969 -3.320780 1.285148
F 7.096208 -1.873086 -1.797302
O -1.099198 0.400066 0.897868
O -3.693705 -1.086864 0.159447
O 2.957936 1.320018 1.789763
N -0.918898 -1.874378 1.389895
N 1.491162 0.681721 0.107866
N -1.058969 -4.039856 2.074043
N -2.364743 -3.434680 2.159231
C 1.158302 -0.569764 0.772007
C 1.680521 -1.839419 0.035104
C -0.372082 -0.611950 1.006625
C 3.115635 -1.800611 -0.436200
C -0.228041 -3.096522 1.610552
C -2.268596 -2.166437 1.738785
C 4.158441 -1.273133 0.371075
C 3.434034 -2.357951 -1.701939
C 2.321629 1.614520 0.727250
C -3.430177 -1.242036 1.606528
C 5.493688 -1.294402 -0.080570
C 4.764004 -2.386195 -2.171123
C 2.436768 2.952621 0.060203
C 5.765087 -1.851045 -1.342807
C 1.404550 3.499893 -0.747301
C 3.618551 3.702928 0.288151
C -4.695571 -0.172497 -0.210263
C 1.567338 4.772032 -1.337320
C 3.781397 4.969710 -0.308274
C 2.758390 5.505032 -1.126836
C -5.496402 0.557050 0.702494
C -4.882683 -0.018605 -1.606694
C -6.482362 1.444908 0.212094
C -5.865116 0.864111 -2.094587
C -6.653317 1.588084 -1.175270
H 1.654300 -0.517543 1.767575
H 1.012547 -2.105978 -0.803923
H 0.976151 0.945398 -0.732980
H 3.935883 -0.821986 1.343494
H 2.637610 -2.777935 -2.327190
H -3.214860 -0.253483 2.051799
H -4.295228 -1.715979 2.106689
H 6.307578 -0.887816 0.525926
H 5.023798 -2.810355 -3.144773
H 0.452118 2.971365 -0.878393
H 4.389757 3.277210 0.937991
H 0.762889 5.195806 -1.947736
H 4.699719 5.540701 -0.135045
H 2.882965 6.491184 -1.587370
H -5.377116 0.449729 1.784089
H -4.257796 -0.598286 -2.292187
H -7.106133 2.012352 0.908581
H -6.016079 0.985057 -3.170954


