%chk=000256403.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256403

0 1
Cl 6.229846 -1.327732 0.688297
O 0.697101 -1.494023 -0.608122
O -1.395275 1.695682 -0.299038
N 0.363371 0.078933 1.034337
N -1.027250 -0.130543 1.039804
C 2.540900 -0.029717 -0.070396
C -3.243541 0.179926 0.054236
C 1.142564 -0.555753 0.018649
C 3.606620 -0.848065 0.321575
C 2.767480 1.257077 -0.576877
C -1.839204 0.669504 0.174701
C -4.290769 0.980291 0.529019
C -3.507441 -1.050617 -0.562953
C 4.903236 -0.341530 0.203254
C 4.077002 1.735261 -0.690716
C 5.157004 0.938902 -0.297387
C -5.609978 0.537441 0.396343
C -4.829356 -1.482917 -0.696585
C -5.878519 -0.691913 -0.214643
H 3.429229 -1.856224 0.702136
H 1.928603 1.880689 -0.894283
H -4.074959 1.943867 0.993176
H -2.690135 -1.661630 -0.950435
H 0.613149 1.030949 1.342221
H -1.272443 -1.118925 1.198339
H 4.257250 2.734445 -1.089573
H 6.180392 1.307200 -0.381738
H -6.428835 1.153899 0.765671
H -5.042155 -2.436393 -1.179127
H -6.908385 -1.033584 -0.318986


%chk=000256403-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256403

0 1
Cl 6.486060 -1.627583 0.230000
O 1.103847 -1.812889 -0.009228
O -1.791204 1.964140 0.101552
N 0.291251 0.333205 0.006756
N -1.003380 -0.187011 0.009372
C 2.728859 0.018921 -0.015512
C -3.439953 0.152151 0.048440
C 1.346277 -0.556286 -0.007473
C 3.795219 -0.910465 0.090926
C 3.011751 1.406127 -0.128288
C -2.054478 0.711930 0.053540
C -4.503163 1.064048 0.274135
C -3.733889 -1.219637 -0.177060
C 5.115452 -0.434840 0.090070
C 4.348895 1.855776 -0.127092
C 5.418377 0.937370 -0.015596
C -5.838421 0.612486 0.285122
C -5.071185 -1.668636 -0.166044
C -6.126450 -0.755511 0.067653
H 3.558278 -1.975514 0.168766
H 2.211508 2.147184 -0.231225
H -4.253249 2.117643 0.435234
H -2.939833 -1.947496 -0.381958
H 0.302582 1.358121 0.048269
H -1.024309 -1.211634 0.017434
H 4.566910 2.924804 -0.216187
H 6.457061 1.279612 -0.014092
H -6.652882 1.323013 0.462083
H -5.290707 -2.726702 -0.344137
H -7.163722 -1.107830 0.075438


