%chk=000190397.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190397

0 1
Cl 5.459762 -2.948414 0.013466
N 0.747036 -1.345307 0.011654
N 2.427665 0.344875 0.001804
N 2.988399 -2.058394 0.012358
N 4.248653 1.880845 -0.007450
N 4.776895 -0.411967 0.002575
C -4.207013 -0.625126 0.002069
C -2.824723 0.041400 0.002944
C -5.330834 0.419965 -0.001535
C -1.702680 -1.005432 0.007647
C -6.713446 -0.245578 -0.002308
C -0.330849 -0.321274 0.008142
C -7.839479 0.798039 -0.005575
C -9.217851 0.140925 -0.007516
C 2.070658 -0.995224 0.008507
C 3.793050 0.590163 -0.000826
C 3.315036 3.039735 -0.011667
C 4.294668 -1.682740 0.009011
C 4.102745 4.342221 0.001381
H -4.307280 -1.287108 -0.880017
H -4.309982 -1.283912 0.886218
H -2.725107 0.699550 -0.882665
H -2.728315 0.704026 0.885557
H -5.230660 1.078776 -0.885767
H -5.233261 1.082118 0.880488
H -1.804074 -1.667131 -0.876143
H -1.807098 -1.662409 0.894596
H -6.816870 -0.904756 0.881028
H -6.814462 -0.907702 -0.883711
H -0.210603 0.339857 0.899304
H -0.208230 0.336362 -0.885317
H -7.742529 1.459464 0.877587
H -7.739166 1.457602 -0.889756
H -9.362854 -0.491569 -0.890726
H -9.365447 -0.491398 0.875389
H -10.014983 0.892846 -0.008746
H 0.498414 -2.333338 0.016688
H 5.253201 2.051694 -0.009894
H 2.640311 2.968320 0.875163
H 2.657881 2.975453 -0.912010
H 4.735271 4.437511 0.893689
H 4.751034 4.446089 -0.878509
H 3.421417 5.203845 -0.000525


%chk=000190397-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190397

0 1
Cl 5.467893 -3.030090 0.011981
N 0.768259 -1.244693 0.008615
N 2.474077 0.378171 0.002234
N 2.971647 -2.022811 0.010344
N 4.302555 1.860782 -0.003110
N 4.791541 -0.424161 0.004008
C -4.240207 -0.603020 0.002454
C -2.852439 0.076022 0.000642
C -5.411812 0.404349 -0.003526
C -1.686109 -0.936664 0.005297
C -6.800147 -0.274246 -0.001085
C -0.310462 -0.243660 0.005128
C -7.973312 0.732222 -0.007168
C -9.356767 0.046273 -0.004352
C 2.097310 -0.940296 0.007052
C 3.829827 0.580998 0.000998
C 3.443685 3.055986 -0.007252
C 4.266131 -1.661487 0.008542
C 4.305725 4.329126 0.002239
H -4.324601 -1.267637 -0.882806
H -4.326386 -1.259144 0.893861
H -2.767163 0.731915 -0.890555
H -2.768314 0.738935 0.886743
H -5.327046 1.060720 -0.895157
H -5.328372 1.069788 0.881484
H -1.767790 -1.594490 -0.884543
H -1.770254 -1.589127 0.898863
H -6.886947 -0.930439 0.890472
H -6.885588 -0.939688 -0.885889
H -0.207549 0.412808 0.891020
H -0.205377 0.408464 -0.883664
H -7.887609 1.396898 0.876933
H -7.886544 1.387433 -0.898203
H -9.480671 -0.599890 -0.894178
H -9.481543 -0.590754 0.891923
H -10.176569 0.788234 -0.008546
H 0.543031 -2.241408 0.012420
H 5.319745 1.957306 -0.005520
H 2.774910 3.028650 0.873925
H 2.788107 3.033570 -0.898683
H 4.942898 4.375243 0.904692
H 4.957089 4.379226 -0.889890
H 3.659448 5.223485 -0.001142


