%chk=000296094.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296094

0 1
Cl -3.489856 2.341368 1.681798
Cl 3.489537 2.340334 -1.682865
O -5.498597 -2.111684 -0.281794
O 5.497187 -2.113637 0.278995
O -7.221361 1.558550 0.445930
O 7.221337 1.556954 -0.443372
N -4.959496 -0.031137 0.576461
N 4.959082 -0.031497 -0.575879
C -0.733686 -0.054184 0.082864
C 0.733257 -0.054251 -0.082633
C -3.544899 -0.063971 0.392722
C 3.544451 -0.064266 -0.392414
C -1.371758 1.017822 0.723713
C 1.371362 1.017420 -0.724016
C -1.504500 -1.126025 -0.397275
C 1.504024 -1.125895 0.398024
C -2.757000 1.005905 0.876059
C 2.756602 1.005374 -0.876356
C -2.888986 -1.133616 -0.248024
C 2.888513 -1.133592 0.248812
C -5.843134 -1.063728 0.229542
C 5.842246 -1.065023 -0.230644
C -7.300504 -0.816954 0.589621
C 7.299720 -0.818378 -0.590361
C -7.854763 0.547984 0.233455
C 7.854524 0.545899 -0.232585
C -9.225387 0.559688 -0.361228
C 9.225428 0.556383 0.361490
H -0.786898 1.855359 1.110181
H 0.786528 1.854771 -1.110926
H -1.015047 -1.961462 -0.901341
H 1.014535 -1.961085 0.902461
H -3.471186 -1.981511 -0.632966
H 3.470717 -1.981343 0.634051
H -5.369236 0.863563 0.916578
H 5.369134 0.863591 -0.914584
H -7.895779 -1.635367 0.120981
H -7.428145 -0.978730 1.685885
H 7.894656 -1.637590 -0.122676
H 7.427328 -0.978912 -1.686814
H -9.957528 0.014954 0.249982
H -9.600157 1.590181 -0.480349
H -9.235395 0.101266 -1.362309
H 9.957086 0.012068 -0.250668
H 9.600646 1.586593 0.481634
H 9.235700 0.096812 1.362041


%chk=000296094-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296094

0 1
Cl -3.684694 2.549790 1.032739
Cl 3.684616 2.549572 -1.031053
O -5.637622 -2.319288 -0.123964
O 5.636288 -2.320569 0.123243
O -7.156889 1.641270 0.448614
O 7.157741 1.639772 -0.449238
N -5.028924 -0.103780 0.411878
N 5.028353 -0.104589 -0.411328
C -0.741520 -0.160024 0.056781
C 0.740948 -0.160135 -0.056289
C -3.620608 -0.163534 0.281547
C 3.620029 -0.164086 -0.281061
C -1.446902 1.017305 0.428430
C 1.446549 1.017230 -0.427413
C -1.507860 -1.329849 -0.196382
C 1.507068 -1.330219 0.196348
C -2.842881 1.001250 0.532856
C 2.842524 1.000962 -0.531850
C -2.909504 -1.340456 -0.089638
C 2.908709 -1.341040 0.089594
C -5.934244 -1.136012 0.220980
C 5.933363 -1.137170 -0.220883
C -7.412763 -0.788617 0.514195
C 7.411935 -0.790312 -0.514521
C -7.904488 0.638130 0.259541
C 7.904441 0.636099 -0.259441
C -9.335934 0.792304 -0.214673
C 9.336211 0.789383 0.214075
H -0.907870 1.937338 0.672054
H 0.907686 1.937472 -0.670622
H -1.003744 -2.247681 -0.516188
H 1.002782 -2.248096 0.515753
H -3.483248 -2.244965 -0.298421
H 3.482289 -2.245749 0.297974
H -5.452458 0.820133 0.628576
H 5.452137 0.819354 -0.627402
H -8.024672 -1.520650 -0.037920
H -7.582873 -0.997698 1.592690
H 8.023687 -1.522854 0.037087
H 7.581580 -0.999036 -1.593161
H -10.023850 0.177431 0.394743
H -9.641112 1.849046 -0.178822
H -9.421385 0.427263 -1.257014
H 10.023439 0.173951 -0.395557
H 9.642090 1.845912 0.177913
H 9.421880 0.424444 1.256430


