%chk=000200402.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200402

0 1
Cl -10.410501 1.179814 -0.017178
O 6.275958 -1.640342 0.379191
O -4.927154 -0.845184 -0.082056
N 1.196825 -0.552300 0.287592
N 3.998357 0.019081 -0.191586
C 2.269794 -1.484886 0.768222
C 1.653635 0.131505 -0.966509
C 3.553754 -0.685610 1.059022
C 2.926921 0.950366 -0.669906
C -0.091318 -1.288884 0.066444
C -1.251871 -0.279943 0.134989
C 5.314493 0.588136 -0.078121
C -2.601148 -0.992784 0.018866
C 6.426347 -0.279285 0.110620
C -3.752404 0.005851 0.114901
C 5.587534 1.959270 -0.233261
C 7.737551 0.201259 0.147096
C 6.901027 2.438913 -0.205725
C 7.975303 1.569581 -0.009466
C -6.167628 -0.260369 -0.045654
C 5.892056 -2.433444 -0.776550
C -6.420013 1.101915 0.165785
C -7.213521 -1.190418 -0.249371
C -7.747400 1.544998 0.173721
C -8.525966 -0.737791 -0.239242
C -8.776542 0.626683 -0.027661
H 2.490248 -2.300176 0.045596
H 1.921779 -1.960458 1.710854
H 0.849157 0.820334 -1.302838
H 1.850276 -0.578688 -1.799392
H 4.363564 -1.383116 1.382461
H 3.375466 0.028316 1.892601
H 2.692921 1.747860 0.069980
H 3.271134 1.440844 -1.605962
H -0.118393 -1.846890 -0.893495
H -0.216238 -2.044592 0.873230
H -1.186459 0.282987 1.089141
H -1.144702 0.477933 -0.665201
H -2.674284 -1.549677 -0.938012
H -2.711933 -1.761666 0.810988
H -3.824653 0.483082 1.106370
H -3.731746 0.764751 -0.684713
H 4.776255 2.671723 -0.366020
H 8.555582 -0.500838 0.302089
H 7.082391 3.505516 -0.331390
H 8.993642 1.950645 0.019493
H 6.682039 -2.385576 -1.530022
H 5.807969 -3.437477 -0.348762
H 4.934872 -2.085663 -1.180076
H -5.616729 1.813749 0.322755
H -6.970935 -2.239197 -0.409235
H -7.971158 2.600156 0.336426
H -9.354151 -1.431117 -0.393332


%chk=000200402-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200402

0 1
Cl -10.559404 1.362765 -0.148727
O 6.301926 -1.702544 0.259408
O -5.005793 -0.991025 -0.057685
N 1.241155 -0.540784 0.399987
N 4.036996 0.111831 -0.047248
C 2.322864 -1.472329 0.810611
C 1.675806 0.229283 -0.790031
C 3.613525 -0.703909 1.126537
C 2.962699 1.020997 -0.497886
C -0.050890 -1.242286 0.201354
C -1.265687 -0.291439 0.177593
C 5.376314 0.596305 -0.061635
C -2.595269 -1.072680 0.068817
C 6.487083 -0.300722 0.092801
C -3.806945 -0.139156 0.064740
C 5.681157 1.974766 -0.257193
C 7.810883 0.176968 0.117129
C 7.012465 2.444530 -0.263883
C 8.087281 1.552287 -0.057449
C -6.258598 -0.362882 -0.072793
C 5.820239 -2.394138 -0.956314
C -6.458458 1.037921 0.021068
C -7.372851 -1.232781 -0.190707
C -7.772256 1.562422 -0.002376
C -8.680228 -0.711172 -0.214346
C -8.863265 0.684643 -0.119260
H 2.534866 -2.229835 0.011961
H 1.996981 -2.015587 1.716971
H 0.883519 0.944312 -1.074397
H 1.858286 -0.448343 -1.664941
H 4.421883 -1.407549 1.380099
H 3.431472 -0.038914 2.001186
H 2.737414 1.799285 0.269152
H 3.285559 1.529669 -1.424025
H -0.045977 -1.860879 -0.735035
H -0.176703 -1.947297 1.046485
H -1.246981 0.317312 1.102447
H -1.186622 0.413866 -0.673813
H -2.609133 -1.678259 -0.857846
H -2.692936 -1.778331 0.916139
H -3.860947 0.446718 1.006233
H -3.764367 0.566621 -0.791660
H 4.866343 2.695467 -0.374723
H 8.613536 -0.555101 0.256008
H 7.204171 3.513416 -0.411108
H 9.120737 1.913638 -0.043492
H 6.566274 -2.299334 -1.768528
H 5.710085 -3.452052 -0.671174
H 4.850301 -1.978426 -1.287368
H -5.615672 1.728419 0.112615
H -7.196043 -2.309949 -0.261569
H -7.934905 2.641746 0.070283
H -9.541886 -1.378585 -0.304715


