%chk=000217802.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217802

0 1
Cl -6.998323 0.897994 -0.701765
O 1.853661 1.564520 1.116371
O -1.359454 -2.682762 0.624090
N 3.465117 0.025019 0.651902
N -1.254258 -0.476379 -0.127542
C 1.151977 -0.242285 -0.311492
C -0.188577 0.532982 -0.409897
C 0.802243 -1.590053 0.339112
C 4.486157 0.882257 1.328132
C 4.061221 -0.944282 -0.305565
C 2.171626 0.549093 0.513704
C 5.367052 1.618376 0.306557
C 4.921222 -0.230727 -1.363886
C 5.993417 0.643162 -0.698492
C -0.714010 -1.704859 0.320770
C -2.636470 -0.142692 -0.249613
C -3.622036 -1.143831 -0.102322
C -3.019962 1.186440 -0.528147
C -4.968889 -0.819908 -0.240303
C -4.371584 1.505868 -0.667634
C -5.328886 0.500838 -0.525156
H 1.557740 -0.402143 -1.338931
H -0.227793 1.360876 0.342677
H -0.327418 0.973426 -1.417534
H 1.159870 -1.659490 1.388896
H 1.254298 -2.450187 -0.188183
H 5.099897 0.223224 1.979689
H 3.965840 1.613419 1.992537
H 3.276069 -1.558803 -0.789810
H 4.691118 -1.650386 0.285479
H 6.157311 2.182313 0.837174
H 4.761978 2.377573 -0.228131
H 4.281342 0.393642 -2.016599
H 5.395710 -0.979489 -2.025647
H 6.553403 1.205187 -1.470065
H 6.738479 0.002495 -0.187894
H -3.334216 -2.177011 0.127719
H -2.282953 1.979809 -0.627680
H -5.734028 -1.589548 -0.126631
H -4.673794 2.531520 -0.882691


%chk=000217802-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217802

0 1
Cl -7.126133 0.861574 -1.032067
O 1.859816 1.532314 1.485674
O -1.390244 -2.820960 0.546965
N 3.504844 0.262058 0.441326
N -1.295475 -0.501798 -0.011077
C 1.086897 -0.198737 -0.061040
C -0.261599 0.565515 -0.073897
C 0.739562 -1.540351 0.641607
C 4.576810 1.000214 1.157022
C 4.002124 -0.806852 -0.454466
C 2.179222 0.603855 0.671634
C 5.583978 1.607994 0.156362
C 5.000237 -0.237758 -1.492034
C 6.149797 0.522074 -0.789000
C -0.760325 -1.738855 0.388399
C -2.670461 -0.203437 -0.239271
C -3.657261 -1.229666 -0.297532
C -3.072390 1.150163 -0.417637
C -5.007361 -0.903211 -0.536632
C -4.423236 1.475558 -0.658853
C -5.376201 0.443320 -0.718670
H 1.382972 -0.405761 -1.104548
H -0.319144 1.240844 0.799600
H -0.382519 1.161427 -0.995274
H 0.896932 -1.476039 1.735418
H 1.305990 -2.410582 0.273043
H 5.100730 0.293469 1.834610
H 4.088969 1.772986 1.771355
H 3.161878 -1.308114 -0.957791
H 4.518535 -1.572435 0.163474
H 6.401322 2.097069 0.719401
H 5.075412 2.393954 -0.434914
H 4.461316 0.449419 -2.173568
H 5.398083 -1.069562 -2.104301
H 6.825937 0.973254 -1.538562
H 6.756235 -0.196823 -0.199691
H -3.360873 -2.268646 -0.144496
H -2.345528 1.964224 -0.354738
H -5.760849 -1.695098 -0.580291
H -4.723903 2.518600 -0.792341


